MTBLS665: MaHPIC Experiment HuC - Metabolomics of plasma samples from human volunteers infected with Plasmodium vivax

Abstract

Project Description:
The Malaria Host-Pathogen Interaction Center (MaHPIC) is a transdisciplinary malaria systems biology research program initially supported by an NIH/NIAID contract (HHSN272201200031C, 2012-2017; see http://www.systemsbiology.emory.edu). The MaHPIC continues with ongoing support from the Defense Advanced Research Project Agency (DARPA) and others. The MaHPIC generates many data types (e.g., clinical, hematological, parasitological, metabolomics, functional genomics, lipidomics, proteomics, immune response, telemetry) and mathematical models, to iteratively test and develop hypotheses related to the complex host-parasite dynamics in the course of malaria in non-human primates (NHPs), and metabolomics data via collaborations with investigators conducting clinical studies in malaria endemic countries, with the overarching goal of better understanding human disease, pathogenesis, and immunity. Curation and maintenance of all data and metadata are the responsibility of the MaHPIC.

MaHPIC Experiment Description:
Sixteen healthy volunteers, 7 malaria naïve and 9 semi-immune, aged 18-45 years, were enrolled in this study during October 2012 to November 2013. Malaria-naive volunteers were recruited in Cali, Colombia, a non-endemic city; those with previous malaria experience were recruited in Buenaventura, a malaria-endemic area on the Colombian Pacific Coast. The study was approved by Institutional Review Boards (IRB) of the Malaria Vaccine and Drug Development Center–MVDC (CECIV, Cali) and Centro Médico Imbanaco (Cali). All protocols and documentation were reviewed and samples shipments approved by the Emory IRB. Male and female patients were eligible for inclusion, which included two steps: 1) age between 15-60 years, hemoglobin levels > 9g/dL, presence of current Plasmodium vivax infection, absence of other Plasmodium species determined by thick blood smear and PCR, blood parasite count of 0.1% or more, absence of other acute or chronic diseases, being able to sign an informed consent form; 2) healthy 18 to 45 years old man or non-pregnant women, capacity to sign an informed consent in a free and voluntary way, acceptable understanding of the clinical trial through the approval of a questionnaire regarding the information given in the consent process, obligatory use of adequate contraceptive method from beginning of recruitment and screening time up to three months after last immunization, do not have chronic or acute diseases, accept not traveling to malaria endemic areas during the clinical trial, have telephone at home or mobile phone that permit permanent contact for follow up, being willing to participated during both steps of the clinical trial. Exclusion criteria included pregnancy, abnormal laboratory test values, hemoglobin pathology, glucose-6-phosphate dehydrogenase (G6PDH) deficiency, positive for blood bank infectious diseases (syphilis, HIV, Chagas disease, HTLV 1–2, and hepatitis B and hepatitis C), or have any condition that would increase the risk of an adverse outcome. Volunteers were infected with P. vivax via sporozoite challenge by exposing volunteers to bites of 2–4 mosquitoes (Anopheles albimanus) of the same infected batch. Plasma samples were collected at 4 time points: Baseline, 1 month pre-inoculation; Diagnosis; 3 weeks post-treatment; 4 months post-treatment. As soon as parasites were detected by thick blood smears, participants were treated orally with curative doses of chloroquine (1500 mg chloroquine provided in three doses: 600 mg initially then 450 mg doses at 24 and 48 hours) and primaquine (30 mg dose given once per day for 14 days). Clinical trial registration: NCT01585077. Samples were analyzed with liquid chromatography coupled to high resolution mass spectrometry (LC-HRMS), evaluated in a time course and between naïve and semi-immune volunteers. Within the MaHPIC, this project is known as ‘Experiment HuC’. Samples were obtained in collaboration with Socrates Herrera from the Malaria Vaccine and Drug Development Center, Colombia. Metabolomics results were produced by Dean Jones at Emory University. To access other publicly available results from HuC and other MaHPIC Experiments visit http://plasmodb.org/plasmo/mahpic.jsp . This page will be updated as datasets are released to the public.

The following contributed to the creation of this dataset: The MaHPIC Consortium, Jeremy D. DeBarry, Mary R. Galinski, Luiz G. Gardinassi, Socrates Herrera, Myriam Arévalo-Herrera, Dean P. Jones, Jessica C. Kissinger, Shuzhao Li, Regina Joice Cordy, Esmeralda VS Meyer, Mustafa V. Nural, Suman B. Pakala, ViLinh Tran, Karan Uppal

Linked Studies: Malaria Host-Pathogen Interaction Center (MaHPIC)

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 Authors: The MaHPIC Consortium, Mary Galinski, Jessica Kissinger, Jeremy DeBarry, Luiz Gardinassi, Socrates Herrera, Myriam Arévalo-Herrera, Dean Jones, Shuzhao Li, Regina Joice Cordy, Esmeralda Meyer, Mustafa Nural, Suman Pakala, ViLinh Tran, Karan Uppal

  Release date: 19-Jun-2018

 Status: Public

Organism(s)

NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax

Homo sapiens

  Study Design

NCIT:Malaria

Anti-malarial treatment

CHMO:ultra-performance liquid chromatography-mass spectrometry

untargeted metabolites

  Experimental Factors

Run order

Time Point

Batch run order

Previous Malaria Infection

Protocol Description
Sample collection Subject Description: Sixteen healthy volunteers, 7 malaria naive and 9 semi-immune, aged 18-45 years, were enrolled in this study during October 2012 to November 2013. Malaria-naïve volunteers were recruited in Cali, Colombia, a non-endemic city; those with previous malaria experience were recruited in Buenaventura, a malaria-endemic area on the Colombian Pacific Coast.

Subject Recruitment Criteria: Male and female patients were eligible for inclusion based on the following criteria;
1) age between 15-60 years, hemoglobin levels > 9g/dL, presence of current P. vivax infection, absence of other Plasmodium species determined by thick blood smear and PCR, blood parasite count of 0.1% or more, absence of other acute or chronic diseases, being able to sign an informed consent form
2) healthy 18 to 45 years old man or non-pregnant women, capacity to sign an informed consent in a free and voluntary way, acceptable understanding of the clinical trial through the approval of a questionnaire regarding the information given in the consent process, obligatory use of adequate contraceptive method from beginning of recruitment and screening time up to three months after last immunization, do not have chronic or acute diseases, accept not traveling to malaria endemic areas during the clinical trial, have telephone at home or mobile phone that permit permanent contact for follow up, being willing to participated during both steps of the clinical trial.
Exclusion criteria included pregnancy, abnormal laboratory test values, hemoglobin pathology, glucose-6-phosphate dehydrogenase (G6PDH) deficiency, positive for blood bank infectious diseases (syphilis, HIV, Chagas disease, HTLV 1–2, and hepatitis B and hepatitis C), or have any condition that would increase the risk of an adverse outcome.

Subject Infection and Treatment: Volunteers were infected with P. vivax via sporozoite challenge by exposing volunteers to bites of 2–4 mosquitoes (Anopheles albimanus) of the same infected batch. Plasma samples were collected at 4 time points: Baseline, 1 month pre-inoculation; Diagnosis; 3 weeks post-treatment; 4 months post-treatment. As soon as parasites were detected by thick blood smears, participants were treated orally with curative doses of chloroquine (1500 mg chloroquine provided in three doses: 600 mg initially then 450 mg doses at 24 and 48 hours) and primaquine (30 mg dose given once per day for 14 days).
See the attached README for more information
Extraction Materials:
Q standard (Qstd): Pooled plasma from Equitech-Bio (Kerrville, TX); from unknown number of males and females without demographic information
NIST: Pooled plasma donated from NIST; from an equal number of healthy men and women aged 40-50 years old.

Stable isotopes: [13C6]-D-glucose, [15N]-indole, [15N,13C5]-L-methionine, [2-15N]-L-lysine dihydrochloride, [13C5]-L-glutamic acid, [15N]-L-tyrosine, [15N2]-uracil, [3,3-13C2]-cystine, [trimethyl-13C3]-caffeine, [U-13C5, U-15N2]-L-glutamine

Sample Preparation: Plasma/Serum

C18 standards: Caffeine (1.5 min, 195.08), Diethyl-toluamide (6-6.6 min, 192.138)

Anion Exchange standards: Cystine (1-1.5 min, 241.04 (+2)), Cysteine-glutathione disulfide/CySSG (2-4 min, 427.09), Carboxymethyl-cysteine/CM-cysteine (very low) (3.5-5 min, 180.03), Glutathione disulfide/GSSG (+1 and +2) (7-8 min, 613.15; 307.08), Carboxymethyl-glutathione/CM-GSH (7-8 min, 366.09)

Acetonitrile HPLC 99.9% Sigma-Aldrich 34998-4L

Method:
1. Sample batches; All samples were randomized to prevent batch degradation in one set of samples. Individual subjects were grouped separately and then samples randomized within the subject group. Example of a batch: Technical triplicates = 20 samples + 2 qstd = 25 hours (6 injections total).
2. One batch of samples thawed per day on ice. 1st batch only – included NIST, Qstd, HILIC, C18, and any other pooled reference; all other batches only Qstd and other pooled references. Isotopes (internal standards) also thawed and spiked in all samples.
3. Stock solution of Acetonitrile/isotope made in Eppendorf tube; Per one sample = 100 µl Acetonitrile + 2.5 µl isotope. Triplicates = 20 samples = 2000 µl Acetonitrile + 50 µl isotope. Plasma sample, Qstd, and NIST prepared the same way.
4. MaHPIC: 30 µl sample aliquoted into Eppendorf tubes (if possible), water added to reach 50 µl of total solution. Qstd, and NIST: 50 µl sample pipetted into Eppendorf tube.
5. 100 µl ACN:isotope stock solution pipetted into Eppendorf tube containing the sample. Samples kept on ice; ACN allowed to crash proteins for 30 mins with a vortex every 15 mins. Centrifuged for 10 mins @ 13.2 rpm at 4 ℃ and supernatant (~100 µl) carefully pipetted into autosampler vial. Clear separation visible (cloudy and clear) → only the clear supernatant pipetted.
6. The orbitrap will end up with the hi-lo-lo pattern for each sample triplicate.
See the attached SOPs for more information
Chromatography Samples were analysed using a Dionex Ultimate 3000 LC coupled with High Field QExactive. Each sample was run in triplicate with dual chromatography (AE/C18/HILIC) and 5-10 µl injection volume on each column. (HFQE switches between polarities without having to wait for 2 hours in between polarity switching.)

See the attached SOPs under Study files tab for more information (MetabolomicsCore-C_Colombia_16JUL2015_04062016-HFQE-Setup_V1.docx)
Mass spectrometry Sample were analysed using a HFQExactive with the following optimized settings;

Positive Mode:
- HESI probe with S-lens combination for ESI
- MS1 mode scanning m/z range of 85-1275
- Resolution - 120,000
- maximum number of ions collected – 1x106
- The maximum injection time - 200
- capillary temperature - 300 °C
- aux gas heater temp - 200 °C
- spray voltage – 3.5 kV
- sheath gas – 45
- auxillary gas flow – 25
- sweep gas flow – 1
- S-lens RF level – 69

Negative Mode:
- HESI probe with S-lens combination for ESI
- MS1 mode scanning m/z range of 85-1275
- Resolution - 120,000
- maximum number of ions collected – 1x106
- The maximum injection time - 200
- capillary temperature - 300 °C
- aux gas heater temp - 200 °C
- spray voltage – 3.0 kV
- sheath gas – 45
- auxiliary gas flow – 25
- sweep gas flow – 1
- S-lens RF level – 69
See the attached SOPs for more information
Data transformation Data Analysis - .raw → .cdf → apLCMS apLCMS is a set of algorithms written to work with the statistical R program. In this set of algorithms, large capacities of LCMS data can be analyzed by realigning the m/z based on certain parameters. The output of apLCMS includes retention times, m/z features that appeared in the LCMS run, and also the ion intensities of each of these m/z features for every sample. The data will be used for further data analysis.
Files were converted to .cdf using Thermo File Converter and then to apLCMS.

Quality Assurance:
1. Five standards were chosen and graphed out to view the intensity over the entire set run. The standards provide information and assurance that the plasma samples were acceptable for further analysis.
2. Total Ion intensity was used as a good indicator on whether the batch was interrupted midway or not.

Data Analysis and Quality Assurance
1. xMSanalyzer: used for data extraction and quality evaluation (https://sourceforge.net/projects/xmsanalyzer/).
All batches are ran together as a whole with xMSanalyzer (include the cdf, profile, rawprof, etc). The r script will run through multiple parameter settings. xMSanalzyer will merge different parameter settings and discard anything with a CV of higher than 50% and generate sample and quality reports. This information is included in the feature table worksheet.
2. Batch-effect evaluation and correction performed using PCA: Batch-effect correction is performed using ComBat [1] implemented in the sva package in R Bioconductor. The associated metabolite identification files for this study contain the ComBat processed feature identification data. Metabolite annotation information can be found in the following attached files and was carried out as outlined below.
HuCColMBHsViCqPS_05042017_E09-C18Neg-Results_MULTIPL.xlsx
HuCColMBHsViCqPS_05042017_E09-HILICPos-Results_MULTIPL.xlsx

Ref:
[1] Johnson WE, Li C & Rabinovic A. Adjusting batch effects in microarray expression data using empirical Bayes methods. Biostatistics 2007 Jan;8(1):118-27. DOI: 10.1093/biostatistics/kxj037
Metabolite identification Metabolite Annotation:
Annotation was performed using xMSannotator.
Specifications:
Chemical database used for annotations: HMDB (release v3.6)
chemical_ID: HMDB ID of the matching chemical
Score_category Confidence level assigned by xMSannotator based on the the mz, retention time, intensity and adduct rules

Description of score categories: (Stage 4 of xMSannotator)
3: High confidence matches that satisfy all criteria (correlated and co-eluting ions that are in the same module and satisfy abundance ratio checks for isotopes and multiple Ms)
2: Medium confidence match: includes chemicals for which all above criteria are satisfied but the ions are not in the same module even though they are correlated. - This category also includes M+H matches that are enriched based on the pathway level information that builds confidence in a match if there are other high scoring matches for chemicals that are in the same KEGG pathway and are also in the same module.
1: Low confidence match: includes matches where either 2M or 3M adducts are present but no single M adduct is present.
0: No confidence match: includes matches where ions are correlated and in the same module, but the delta retention time is greater than the maximum threshold; or if the M+1 or M+2 form is present in the absence of M. This category also includes M+H matches that can not be associated with a single m/z.
Source Name Organism Organism part Protocol REF Sample Name Previous Malaria Infection Time Point
nist Homo sapiens blood plasma Sample collection nist N/A
q3June2014_1a Homo sapiens blood plasma Sample collection q3June2014_1a N/A
2588793 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588793 Semi-immune 3 weeks
2588791 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588791 Semi-immune Baseline
2588882 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588882 Semi-immune 4 months
2588863 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588863 Naive Baseline
2588883 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588883 Semi-immune Baseline
2588881 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588881 Semi-immune 3 weeks
2588872 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588872 Semi-immune Diagnosis
2588871 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588871 Semi-immune Baseline
2588894 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588894 Semi-immune 4 months
2588879 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588879 Semi-immune Baseline
2588861 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588861 Naive 3 weeks
2588862 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588862 Naive 4 months
2588889 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588889 Semi-immune 3 weeks
2588886 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588886 Semi-immune 4 months
2588890 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588890 Semi-immune 4 months
2588893 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588893 Semi-immune 3 weeks
2588865 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588865 Naive 3 weeks
2588860 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588860 Naive Diagnosis
2588887 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588887 Semi-immune Baseline
2588891 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588891 Semi-immune Baseline
2588884 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588884 Semi-immune Diagnosis
2588874 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588874 Semi-immune 4 months
2588880 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588880 Semi-immune Diagnosis
2588792 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588792 Semi-immune Diagnosis
2588794 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588794 Semi-immune 4 months
2588864 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588864 Naive Diagnosis
2588885 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588885 Semi-immune 3 weeks
2588892 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588892 Semi-immune Diagnosis
2588873 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588873 Semi-immune 3 weeks
2588859 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588859 Naive Baseline
2588866 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588866 Naive 4 months
2588888 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588888 Semi-immune Diagnosis
q3June2014_1b Homo sapiens blood plasma Sample collection q3June2014_1b N/A
q3June2014_2a Homo sapiens blood plasma Sample collection q3June2014_2a N/A
2588852 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588852 Naive Diagnosis
2588869 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588869 Naive 3 weeks
2588844 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588844 Semi-immune Diagnosis
2588851 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588851 Naive Baseline
2588870 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588870 Naive 4 months
2588877 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588877 Semi-immune 3 weeks
2588878 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588878 Semi-immune 4 months
2588875 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588875 Semi-immune Baseline
2588846 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588846 Semi-immune 4 months
2588855 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588855 Semi-immune Baseline
2588839 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588839 Naive Baseline
2588845 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588845 Semi-immune 3 weeks
2588843 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588843 Semi-immune Baseline
2588876 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588876 Semi-immune Diagnosis
2588856 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588856 Semi-immune Diagnosis
2588854 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588854 Naive 4 months
2588868 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588868 Naive Diagnosis
2588847 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588847 Naive Baseline
2588840 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588840 Naive Diagnosis
2588858 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588858 Semi-immune 4 months
2588867 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588867 Naive Baseline
2588857 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588857 Semi-immune 3 weeks
2588848 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588848 Naive Diagnosis
2588849 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588849 Naive 3 weeks
2588850 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588850 Naive 4 months
2588853 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588853 Naive 3 weeks
2588841 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588841 Naive 3 weeks
2588842 NCBITAXON:Homo sapiens;NCBITAXON:Plasmodium vivax blood plasma Sample collection 2588842 Naive 4 months
q3June2014_2b Homo sapiens blood plasma Sample collection q3June2014_2b N/A
nist2 Homo sapiens blood plasma Sample collection nist2 N/A

Assay  1

Assay file name: a_huc_hilicpos.txt
Technology: mass spectrometry
Platform: Exactive (Thermo Scientific)

Instrumentation

Sample Name Protocol REF Post Extraction Derivatization Extract Name Protocol REF Chromatography Instrument Column model Column type Labeled Extract Name Label Protocol REF Scan polarity Scan m/z range Instrument Ion source Mass analyzer MS Assay Name Raw Spectral Data File Protocol REF Normalization Name Derived Spectral Data File Protocol REF Data Transformation Name Metabolite Assignment File Batch run order Run order Time Point Previous Malaria Infection
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_001 VT_150411_001.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 1 N/A N/A
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_003 VT_150411_003.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 3 N/A N/A
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_005 VT_150411_005.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 5 N/A N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_007 VT_150411_007.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 7 N/A N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_009 VT_150411_009.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 9 N/A N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_011 VT_150411_011.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 11 N/A N/A
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_013 VT_150411_013.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 13 3 weeks Semi-immune
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_015 VT_150411_015.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 15 3 weeks Semi-immune
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_017 VT_150411_017.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 17 3 weeks Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_019 VT_150411_019.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 19 Baseline Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_021 VT_150411_021.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 21 Baseline Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_023 VT_150411_023.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 23 Baseline Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_025 VT_150411_025.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 25 4 months Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_027 VT_150411_027.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 27 4 months Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_029 VT_150411_029.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 29 4 months Semi-immune
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_031 VT_150411_031.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 31 Baseline Naive
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_033 VT_150411_033.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 33 Baseline Naive
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_035 VT_150411_035.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 35 Baseline Naive
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_037 VT_150411_037.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 37 Baseline Semi-immune
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_039 VT_150411_039.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 39 Baseline Semi-immune
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_041 VT_150411_041.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 41 Baseline Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_043 VT_150411_043.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 43 3 weeks Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_045 VT_150411_045.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 45 3 weeks Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_047 VT_150411_047.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 47 3 weeks Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_049 VT_150411_049.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 49 Diagnosis Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_051 VT_150411_051.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 51 Diagnosis Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_053 VT_150411_053.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 53 Diagnosis Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_055 VT_150411_055.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 55 Baseline Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_057 VT_150411_057.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 57 Baseline Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_059 VT_150411_059.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 59 Baseline Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_061 VT_150411_061.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 61 4 months Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_063 VT_150411_063.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 63 4 months Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_065 VT_150411_065.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 65 4 months Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_067 VT_150411_067.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 67 Baseline Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_069 VT_150411_069.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 69 Baseline Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_071 VT_150411_071.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 71 Baseline Semi-immune
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_073 VT_150411_073.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 73 3 weeks Naive
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_075 VT_150411_075.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 75 3 weeks Naive
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_077 VT_150411_077.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 77 3 weeks Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_079 VT_150411_079.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 79 4 months Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_081 VT_150411_081.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 81 4 months Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_083 VT_150411_083.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 83 4 months Naive
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_085 VT_150411_085.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 85 3 weeks Semi-immune
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_087 VT_150411_087.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 87 3 weeks Semi-immune
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_089 VT_150411_089.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 89 3 weeks Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_091 VT_150411_091.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 91 4 months Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_093 VT_150411_093.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 93 4 months Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_095 VT_150411_095.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 95 4 months Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_097 VT_150411_097.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 97 4 months Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_099 VT_150411_099.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 99 4 months Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_101 VT_150411_101.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 101 4 months Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_103 VT_150411_103.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 103 3 weeks Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_105 VT_150411_105.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 105 3 weeks Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_107 VT_150411_107.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 107 3 weeks Semi-immune
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_109 VT_150411_109.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 109 3 weeks Naive
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_111 VT_150411_111.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 111 3 weeks Naive
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_113 VT_150411_113.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 113 3 weeks Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_115 VT_150411_115.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 115 Diagnosis Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_117 VT_150411_117.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 117 Diagnosis Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_119 VT_150411_119.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 119 Diagnosis Naive
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_121 VT_150411_121.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 121 Baseline Semi-immune
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_123 VT_150411_123.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 123 Baseline Semi-immune
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_125 VT_150411_125.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 125 Baseline Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_127 VT_150411_127.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 127 Baseline Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_129 VT_150411_129.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 129 Baseline Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_131 VT_150411_131.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 131 Baseline Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_133 VT_150411_133.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 133 Diagnosis Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_135 VT_150411_135.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 135 Diagnosis Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_137 VT_150411_137.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 137 Diagnosis Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_139 VT_150411_139.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 139 4 months Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_141 VT_150411_141.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 141 4 months Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_143 VT_150411_143.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 143 4 months Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_145 VT_150411_145.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 145 Diagnosis Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_147 VT_150411_147.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 147 Diagnosis Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_149 VT_150411_149.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 149 Diagnosis Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_151 VT_150411_151.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 151 Diagnosis Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_153 VT_150411_153.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 153 Diagnosis Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_155 VT_150411_155.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 155 Diagnosis Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_157 VT_150411_157.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 157 4 months Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_159 VT_150411_159.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 159 4 months Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_161 VT_150411_161.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 161 4 months Semi-immune
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_163 VT_150411_163.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 163 Diagnosis Naive
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_165 VT_150411_165.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 165 Diagnosis Naive
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_167 VT_150411_167.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 167 Diagnosis Naive
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_169 VT_150411_169.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 169 3 weeks Semi-immune
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_171 VT_150411_171.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 171 3 weeks Semi-immune
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_173 VT_150411_173.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 173 3 weeks Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_175 VT_150411_175.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 175 Diagnosis Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_177 VT_150411_177.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 177 Diagnosis Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_179 VT_150411_179.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 179 Diagnosis Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_181 VT_150411_181.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 181 3 weeks Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_183 VT_150411_183.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 183 3 weeks Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_185 VT_150411_185.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 185 3 weeks Semi-immune
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_187 VT_150411_187.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 187 Baseline Naive
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_189 VT_150411_189.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 189 Baseline Naive
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_191 VT_150411_191.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 191 Baseline Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_193 VT_150411_193.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 193 4 months Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_195 VT_150411_195.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 195 4 months Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_197 VT_150411_197.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 197 4 months Naive
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_199 VT_150411_199.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 199 Diagnosis Semi-immune
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_201 VT_150411_201.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 201 Diagnosis Semi-immune
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_203 VT_150411_203.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 203 Diagnosis Semi-immune
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_205 VT_150411_205.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 205 N/A N/A
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_207 VT_150411_207.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 207 N/A N/A
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_209 VT_150411_209.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 1 209 N/A N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_001 VT_150821_001.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 211 N/A N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_003 VT_150821_003.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 213 N/A N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_005 VT_150821_005.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 215 N/A N/A
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_007 VT_150821_007.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 217 Diagnosis Naive
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_009 VT_150821_009.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 219 Diagnosis Naive
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_011 VT_150821_011.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 221 Diagnosis Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_013 VT_150821_013.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 223 3 weeks Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_015 VT_150821_015.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 225 3 weeks Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_017 VT_150821_017.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 227 3 weeks Naive
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_019 VT_150821_019.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 229 Diagnosis Semi-immune
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_021 VT_150821_021.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 231 Diagnosis Semi-immune
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_023 VT_150821_023.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 233 Diagnosis Semi-immune
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_025 VT_150821_025.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 235 Baseline Naive
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_027 VT_150821_027.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 237 Baseline Naive
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_029 VT_150821_029.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 239 Baseline Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_031 VT_150821_031.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 241 4 months Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_033 VT_150821_033.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 243 4 months Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_035 VT_150821_035.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 245 4 months Naive
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_037 VT_150821_037.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 247 3 weeks Semi-immune
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_039 VT_150821_039.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 249 3 weeks Semi-immune
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_041 VT_150821_041.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 251 3 weeks Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_043 VT_150821_043.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 253 4 months Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_045 VT_150821_045.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 255 4 months Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_047 VT_150821_047.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 257 4 months Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_049 VT_150821_049.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 259 Baseline Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_051 VT_150821_051.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 261 Baseline Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_053 VT_150821_053.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 263 Baseline Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_055 VT_150821_055.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 265 4 months Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_057 VT_150821_057.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 267 4 months Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_059 VT_150821_059.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 269 4 months Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_061 VT_150821_061.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 271 Baseline Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_063 VT_150821_063.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 273 Baseline Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_065 VT_150821_065.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 275 Baseline Semi-immune
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_067 VT_150821_067.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 277 Baseline Naive
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_069 VT_150821_069.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 279 Baseline Naive
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_071 VT_150821_071.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 281 Baseline Naive
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_073 VT_150821_073.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 283 3 weeks Semi-immune
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_075 VT_150821_075.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 285 3 weeks Semi-immune
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_077 VT_150821_077.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 287 3 weeks Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_079 VT_150821_079.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 289 Baseline Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_081 VT_150821_081.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 291 Baseline Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_083 VT_150821_083.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 293 Baseline Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_085 VT_150821_085.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 295 Diagnosis Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_087 VT_150821_087.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 297 Diagnosis Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_089 VT_150821_089.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 299 Diagnosis Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_091 VT_150821_091.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 301 Diagnosis Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_093 VT_150821_093.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 303 Diagnosis Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_095 VT_150821_095.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 305 Diagnosis Semi-immune
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_097 VT_150821_097.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 307 4 months Naive
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_099 VT_150821_099.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 309 4 months Naive
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_101 VT_150821_101.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 311 4 months Naive
2588868 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_103 VT_150821_103.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 313 Diagnosis Naive
2588868 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_105 VT_150821_105.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 315 Diagnosis Naive
2588868 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_107 VT_150821_107.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 317 Diagnosis Naive
2588847 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_109 VT_150821_109.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 319 Baseline Naive
2588847 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_111 VT_150821_111.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 321 Baseline Naive
2588847 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_113 VT_150821_113.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 323 Baseline Naive
2588840 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_115 VT_150821_115.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 325 Diagnosis Naive
2588840 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_117 VT_150821_117.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 327 Diagnosis Naive
2588840 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_119 VT_150821_119.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 329 Diagnosis Naive
2588858 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_121 VT_150821_121.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 331 4 months Semi-immune
2588858 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_123 VT_150821_123.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 333 4 months Semi-immune
2588858 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_125 VT_150821_125.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 335 4 months Semi-immune
2588867 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_127 VT_150821_127.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 337 Baseline Naive
2588867 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_129 VT_150821_129.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 339 Baseline Naive
2588867 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_131 VT_150821_131.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 341 Baseline Naive
2588857 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_133 VT_150821_133.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 343 3 weeks Semi-immune
2588857 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_135 VT_150821_135.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 345 3 weeks Semi-immune
2588857 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_137 VT_150821_137.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 347 3 weeks Semi-immune
2588848 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_139 VT_150821_139.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 349 Diagnosis Naive
2588848 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_141 VT_150821_141.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 351 Diagnosis Naive
2588848 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_143 VT_150821_143.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 353 Diagnosis Naive
2588849 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_145 VT_150821_145.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 355 3 weeks Naive
2588849 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_147 VT_150821_147.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 357 3 weeks Naive
2588849 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_149 VT_150821_149.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 359 3 weeks Naive
2588850 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_151 VT_150821_151.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 361 4 months Naive
2588850 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_153 VT_150821_153.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 363 4 months Naive
2588850 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_155 VT_150821_155.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 365 4 months Naive
2588853 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_157 VT_150821_157.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 367 3 weeks Naive
2588853 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_159 VT_150821_159.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 369 3 weeks Naive
2588853 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_161 VT_150821_161.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 371 3 weeks Naive
2588841 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_163 VT_150821_163.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 373 3 weeks Naive
2588841 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_165 VT_150821_165.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 375 3 weeks Naive
2588841 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_167 VT_150821_167.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 377 3 weeks Naive
2588842 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_169 VT_150821_169.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 379 4 months Naive
2588842 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_171 VT_150821_171.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 381 4 months Naive
2588842 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_173 VT_150821_173.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 383 4 months Naive
q3June2014_2b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_175 VT_150821_175.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 385 N/A N/A
q3June2014_2b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_177 VT_150821_177.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 387 N/A N/A
q3June2014_2b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_179 VT_150821_179.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 389 N/A N/A
nist2 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_181 VT_150821_181.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 391 N/A N/A
nist2 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_183 VT_150821_183.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 393 N/A N/A
nist2 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system Accucore HILIC (2.6 µm, 2.1 mm x 50 mm; Thermo Scientific) HILIC Mass spectrometry positive 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_185 VT_150821_185.cdf Data transformation Metabolite identification m_huc_hilicpos.tsv 2 395 N/A N/A

Assay  2

Assay file name: a_huc_c18neg.txt
Technology: mass spectrometry
Platform: Exactive (Thermo Scientific)

Instrumentation

Sample Name Protocol REF Post Extraction Derivatization Extract Name Protocol REF Chromatography Instrument Column model Column type Labeled Extract Name Label Protocol REF Scan polarity Scan m/z range Instrument Ion source Mass analyzer MS Assay Name Raw Spectral Data File Protocol REF Normalization Name Derived Spectral Data File Protocol REF Data Transformation Name Metabolite Assignment File Time Point Batch run order Run order Previous Malaria Infection
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_002 VT_150411_002.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 2 N/A
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_004 VT_150411_004.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 4 N/A
nist Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_006 VT_150411_006.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 6 N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_008 VT_150411_008.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 8 N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_010 VT_150411_010.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 10 N/A
q3June2014_1a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_012 VT_150411_012.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 12 N/A
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_014 VT_150411_014.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 14 Semi-immune
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_016 VT_150411_016.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 16 Semi-immune
2588793 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_018 VT_150411_018.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 18 Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_020 VT_150411_020.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 20 Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_022 VT_150411_022.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 22 Semi-immune
2588791 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_024 VT_150411_024.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 24 Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_026 VT_150411_026.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 26 Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_028 VT_150411_028.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 28 Semi-immune
2588882 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_030 VT_150411_030.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 30 Semi-immune
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_032 VT_150411_032.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 32 Naive
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_034 VT_150411_034.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 34 Naive
2588863 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_036 VT_150411_036.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 36 Naive
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_038 VT_150411_038.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 38 Semi-immune
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_040 VT_150411_040.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 40 Semi-immune
2588883 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_042 VT_150411_042.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 42 Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_044 VT_150411_044.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 44 Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_046 VT_150411_046.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 46 Semi-immune
2588881 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_048 VT_150411_048.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 48 Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_050 VT_150411_050.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 50 Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_052 VT_150411_052.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 52 Semi-immune
2588872 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_054 VT_150411_054.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 54 Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_056 VT_150411_056.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 56 Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_058 VT_150411_058.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 58 Semi-immune
2588871 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_060 VT_150411_060.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 60 Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_062 VT_150411_062.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 62 Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_064 VT_150411_064.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 64 Semi-immune
2588894 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_066 VT_150411_066.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 66 Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_068 VT_150411_068.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 68 Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_070 VT_150411_070.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 70 Semi-immune
2588879 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_072 VT_150411_072.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 72 Semi-immune
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_074 VT_150411_074.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 74 Naive
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_076 VT_150411_076.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 76 Naive
2588861 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_078 VT_150411_078.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 78 Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_080 VT_150411_080.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 80 Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_082 VT_150411_082.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 82 Naive
2588862 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_084 VT_150411_084.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 84 Naive
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_086 VT_150411_086.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 86 Semi-immune
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_088 VT_150411_088.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 88 Semi-immune
2588889 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_090 VT_150411_090.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 90 Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_092 VT_150411_092.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 92 Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_094 VT_150411_094.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 94 Semi-immune
2588886 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_096 VT_150411_096.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 96 Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_098 VT_150411_098.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 98 Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_100 VT_150411_100.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 100 Semi-immune
2588890 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_102 VT_150411_102.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 102 Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_104 VT_150411_104.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 104 Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_106 VT_150411_106.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 106 Semi-immune
2588893 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_108 VT_150411_108.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 108 Semi-immune
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_110 VT_150411_110.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 110 Naive
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_112 VT_150411_112.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 112 Naive
2588865 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_114 VT_150411_114.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 114 Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_116 VT_150411_116.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 116 Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_118 VT_150411_118.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 118 Naive
2588860 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_120 VT_150411_120.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 120 Naive
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_122 VT_150411_122.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 122 Semi-immune
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_124 VT_150411_124.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 124 Semi-immune
2588887 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_126 VT_150411_126.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 126 Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_128 VT_150411_128.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 128 Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_130 VT_150411_130.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 130 Semi-immune
2588891 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_132 VT_150411_132.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 132 Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_134 VT_150411_134.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 134 Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_136 VT_150411_136.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 136 Semi-immune
2588884 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_138 VT_150411_138.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 138 Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_140 VT_150411_140.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 140 Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_142 VT_150411_142.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 142 Semi-immune
2588874 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_144 VT_150411_144.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 144 Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_146 VT_150411_146.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 146 Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_148 VT_150411_148.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 148 Semi-immune
2588880 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_150 VT_150411_150.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 150 Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_152 VT_150411_152.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 152 Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_154 VT_150411_154.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 154 Semi-immune
2588792 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_156 VT_150411_156.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 156 Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_158 VT_150411_158.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 158 Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_160 VT_150411_160.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 160 Semi-immune
2588794 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_162 VT_150411_162.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 162 Semi-immune
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_164 VT_150411_164.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 164 Naive
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_166 VT_150411_166.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 166 Naive
2588864 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_168 VT_150411_168.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 168 Naive
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_170 VT_150411_170.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 170 Semi-immune
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_172 VT_150411_172.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 172 Semi-immune
2588885 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_174 VT_150411_174.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 174 Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_176 VT_150411_176.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 176 Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_178 VT_150411_178.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 178 Semi-immune
2588892 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_180 VT_150411_180.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 180 Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_182 VT_150411_182.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 182 Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_184 VT_150411_184.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 184 Semi-immune
2588873 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_186 VT_150411_186.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 1 186 Semi-immune
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_188 VT_150411_188.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 188 Naive
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_190 VT_150411_190.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 190 Naive
2588859 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_192 VT_150411_192.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 1 192 Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_194 VT_150411_194.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 194 Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_196 VT_150411_196.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 196 Naive
2588866 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_198 VT_150411_198.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 1 198 Naive
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_200 VT_150411_200.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 200 Semi-immune
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_202 VT_150411_202.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 202 Semi-immune
2588888 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_204 VT_150411_204.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 1 204 Semi-immune
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_206 VT_150411_206.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 206 N/A
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_208 VT_150411_208.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 208 N/A
q3June2014_1b Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150411_210 VT_150411_210.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 1 210 N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_002 VT_150821_002.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 2 212 N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_004 VT_150821_004.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 2 214 N/A
q3June2014_2a Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_006 VT_150821_006.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 2 216 N/A
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_008 VT_150821_008.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 218 Naive
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_010 VT_150821_010.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 220 Naive
2588852 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_012 VT_150821_012.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 222 Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_014 VT_150821_014.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 224 Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_016 VT_150821_016.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 226 Naive
2588869 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_018 VT_150821_018.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 228 Naive
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_020 VT_150821_020.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 230 Semi-immune
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_022 VT_150821_022.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 232 Semi-immune
2588844 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_024 VT_150821_024.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 234 Semi-immune
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_026 VT_150821_026.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 236 Naive
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_028 VT_150821_028.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 238 Naive
2588851 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_030 VT_150821_030.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 240 Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_032 VT_150821_032.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 242 Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_034 VT_150821_034.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 244 Naive
2588870 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_036 VT_150821_036.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 246 Naive
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_038 VT_150821_038.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 248 Semi-immune
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_040 VT_150821_040.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 250 Semi-immune
2588877 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_042 VT_150821_042.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 252 Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_044 VT_150821_044.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 254 Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_046 VT_150821_046.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 256 Semi-immune
2588878 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_048 VT_150821_048.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 258 Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_050 VT_150821_050.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 260 Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_052 VT_150821_052.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 262 Semi-immune
2588875 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_054 VT_150821_054.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 264 Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_056 VT_150821_056.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 266 Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_058 VT_150821_058.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 268 Semi-immune
2588846 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_060 VT_150821_060.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 270 Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_062 VT_150821_062.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 272 Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_064 VT_150821_064.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 274 Semi-immune
2588855 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_066 VT_150821_066.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 276 Semi-immune
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_068 VT_150821_068.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 278 Naive
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_070 VT_150821_070.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 280 Naive
2588839 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_072 VT_150821_072.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 282 Naive
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_074 VT_150821_074.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 284 Semi-immune
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_076 VT_150821_076.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 286 Semi-immune
2588845 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_078 VT_150821_078.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 3 weeks 2 288 Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_080 VT_150821_080.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 290 Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_082 VT_150821_082.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 292 Semi-immune
2588843 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_084 VT_150821_084.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Baseline 2 294 Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_086 VT_150821_086.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 296 Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_088 VT_150821_088.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 298 Semi-immune
2588876 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_090 VT_150821_090.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 300 Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_092 VT_150821_092.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 302 Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_094 VT_150821_094.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 304 Semi-immune
2588856 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_096 VT_150821_096.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 306 Semi-immune
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_098 VT_150821_098.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 308 Naive
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_100 VT_150821_100.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 310 Naive
2588854 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_102 VT_150821_102.cdf Data transformation Metabolite identification m_huc_c18neg.tsv 4 months 2 312 Naive
2588868 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_104 VT_150821_104.cdf Data transformation Metabolite identification m_huc_c18neg.tsv Diagnosis 2 314 Naive
2588868 Extraction Chromatography Thermo Scientific Dionex Ultimate 3000 HPLC system TARGA C18 (5 µm, 2.1 mm x 50 mm; Higgins Analytical) reverse phase Mass spectrometry negative 85-1275 Thermo Scientific Q Exactive HF electrospray ionization MS:orbitrap VT_150821_106 VT_150821_106.cdf Data transformation Metabolite identification