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CHEBI:169674 - 6-Phenyl-3-hexen-2-one

ChEBI IDCHEBI:169674
ChEBI Name6-Phenyl-3-hexen-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O
Net Charge0
Average Mass174.243
Monoisotopic Mass174.10447
SMILESCC(=O)/C=C/CCc1ccccc1
InChIInChI=1S/C12H14O/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-5,7-9H,6,10H2,1H3/b7-5+
InChIKeyPHEPHOADHFLZJS-FNORWQNLSA-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)
6-Phenyl-3-hexen-2-one (CHEBI:169674) is a benzenes (CHEBI:22712)
IUPAC Name 
(E)-6-phenylhex-3-en-2-one
Manual XrefsDatabases
HMDB0031622HMDB
4519727ChemSpider
Registry NumbersSources
CAS:33046-41-2ChemIDplus