4-Methyl-4E-hexen-3-one (CHEBI:195665)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	4-Methyl-4E-hexen-3-one

ChEBI ID	CHEBI:195665

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C7H12O

Net Charge

Average Mass

112.172

Monoisotopic Mass

112.08882

InChI

InChI=1S/C7H12O/c1-4-6(3)7(8)5-2/h4H,5H2,1-3H3/b6-4+

InChIKey

LJQNVNNQRWKTJP-GQCTYLIASA-N

SMILES

O=C(CC)/C(/C)=C/C

ChEBI Ontology
Outgoing	4-Methyl-4E-hexen-3-one (CHEBI:195665) is a enone (CHEBI:51689)

IUPAC Name

(E)-4-methylhex-4-en-3-one