3-Methylene-2-octanone (CHEBI:195704)

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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	3-Methylene-2-octanone

ChEBI ID	CHEBI:195704

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H16O

Net Charge

Average Mass

140.226

Monoisotopic Mass

140.12012

InChI

InChI=1S/C9H16O/c1-4-5-6-7-8(2)9(3)10/h2,4-7H2,1,3H3

InChIKey

VBZQKPYXKJXTHZ-UHFFFAOYSA-N

SMILES

O=C(C(CCCCC)=C)C

ChEBI Ontology
Outgoing	3-Methylene-2-octanone (CHEBI:195704) is a enone (CHEBI:51689)

IUPAC Name

3-methylideneoctan-2-one