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CHEBI:168799 - Methyl 2E-hexenoate

ChEBI IDCHEBI:168799
ChEBI NameMethyl 2E-hexenoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O2
Net Charge0
Average Mass128.171
Monoisotopic Mass128.08373
SMILESCCC/C=C/C(=O)OC
InChIInChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h5-6H,3-4H2,1-2H3/b6-5+
InChIKeyGFUGBRNILVVWIE-AATRIKPKSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Methyl 2E-hexenoate (CHEBI:168799) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
methyl (E)-hex-2-enoate
Manual XrefsDatabases
4516564ChemSpider
HMDB0031500HMDB
LMFA07010940LIPID MAPS
Registry NumbersSources
CAS:13894-63-8ChemIDplus