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CHEBI:230359 - N-(3-Aminopropyl)-N-methylcarbamic acid tert-butyl ester

Default Structure
ChEBI IDCHEBI:230359
ChEBI NameN-(3-Aminopropyl)-N-methylcarbamic acid tert-butyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H20N2O2
Net Charge0
Average Mass188.271
Monoisotopic Mass188.15248
SMILESCN(CCCN)C(=O)OC(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-9(2,3)13-8(12)11(4)7-5-6-10/h5-7,10H2,1-4H3
InChIKeyPNQYAMWGTGWJDW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
N-(3-Aminopropyl)-N-methylcarbamic acid tert-butyl ester (CHEBI:230359) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
tert-butyl N-(3-aminopropyl)-N-methylcarbamate
Manual XrefsDatabases
2037307ChemSpider
HMDB0244680HMDB