CHEBI:52052 - phenylacetone

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ChEBI Name phenylacetone ChEBI ID CHEBI:52052 Definition A propanone that is propan-2-one substituted by a phenyl group at position 1. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C9H10O Net Charge 0 Average Mass 134.17510 Monoisotopic Mass 134.07316 InChI InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3 InChIKey QCCDLTOVEPVEJK-UHFFFAOYSA-N SMILES CC(=O)Cc1ccccc1 ChEBI Ontology Outgoing phenylacetone (CHEBI:52052) is a methyl ketone (CHEBI:51867) phenylacetone (CHEBI:52052) is a propanones (CHEBI:26292) IUPAC Name 1-phenylpropan-2-one Synonyms Sources 1-Phenyl-2-propanone SUBMITTER 1-Phenyl-2-propanone KEGG COMPOUND 3-Phenyl-2-propanone ChemIDplus Benzyl methyl ketone ChemIDplus Methyl benzyl ketone ChemIDplus Phenyl-2-propanone ChemIDplus phenylacetone UniProt Phenylacetone SUBMITTER Phenylmethyl methyl ketone ChemIDplus Manual Xrefs Databases C15512 KEGG COMPOUND CPD-7233 MetaCyc Phenylacetone Wikipedia View more database links Registry Numbers Types Sources 103-79-7 CAS Registry Number ChemIDplus 103-79-7 CAS Registry Number SUBMITTER 103-79-7 CAS Registry Number NIST Chemistry WebBook 742120 Reaxys Registry Number Reaxys 742120 Beilstein Registry Number Beilstein Citation Type Source 9682156 PubMed citation Europe PMC Last Modified 22 July 2015