4-hydroxy-4-phenylbutan-2-one (CHEBI:193705)

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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-hydroxy-4-phenylbutan-2-one

ChEBI ID	CHEBI:193705

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H12O2

Net Charge

Average Mass

164.204

Monoisotopic Mass

164.08373

InChI

InChI=1S/C10H12O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6,10,12H,7H2,1H3

InChIKey

MUVVFSVVVHYLMQ-UHFFFAOYSA-N

SMILES

OC(CC(=O)C)C1=CC=CC=C1

Metabolite of Species	Details
mock community culture	Found in Whole Organism (NCIT:C13413). See: MetaboLights Study

ChEBI Ontology
Outgoing	4-hydroxy-4-phenylbutan-2-one (CHEBI:193705) is a benzenes (CHEBI:22712)

IUPAC Name

4-hydroxy-4-phenylbutan-2-one