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CHEBI:172020 - 2-Ethylidenehexanal

ChEBI IDCHEBI:172020
ChEBI Name2-Ethylidenehexanal
Stars
Last Modified7 June 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H14O
Net Charge0
Average Mass126.199
Monoisotopic Mass126.10447
SMILESC/C=C(/C=O)CCCC
InChIInChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h4,7H,3,5-6H2,1-2H3/b8-4+
InChIKeyRAPHJZMCZKGDSB-XBXARRHUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
2-Ethylidenehexanal (CHEBI:172020) is a monounsaturated fatty aldehyde (CHEBI:61870)
IUPAC Name 
(2E)-2-ethylidenehexanal
Manual XrefsDatabases
HMDB0037152HMDB
10304630ChemSpider
Registry NumbersSources
CAS:87745-65-1ChemIDplus