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CHEBI:171821 - Hexyl 2E-hexenoate

ChEBI IDCHEBI:171821
ChEBI NameHexyl 2E-hexenoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O2
Net Charge0
Average Mass198.306
Monoisotopic Mass198.16198
SMILESCCC/C=C/C(=O)OCCCCCC
InChIInChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h8,10H,3-7,9,11H2,1-2H3/b10-8+
InChIKeyNGQTTWDHJIMWOI-CSKARUKUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Hexyl 2E-hexenoate (CHEBI:171821) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
hexyl (E)-hex-2-enoate
Manual XrefsDatabases
4940550ChemSpider
HMDB0038269HMDB
LMFA07010904LIPID MAPS
Registry NumbersSources
CAS:33855-57-1ChemIDplus