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CHEBI:194596 - 3-Acetylbenzonitrile

ChEBI IDCHEBI:194596
ChEBI Name3-Acetylbenzonitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H7NO
Net Charge0
Average Mass145.161
Monoisotopic Mass145.05276
SMILESCC(=O)c1cccc(C#N)c1
InChIInChI=1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3
InChIKeySBCFGFDAZCTSRH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Acetylbenzonitrile (CHEBI:194596) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
3-acetylbenzonitrile
Manual XrefsDatabases
72466ChemSpider