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4-Methyl-beta-Oxo-Benzenepropanenitrile
[CAS# 7391-28-8]

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Identification
Classification Chemical reagent >> Organic reagent >> Cyanide/nitrile
Name 4-Methyl-beta-Oxo-Benzenepropanenitrile
Synonyms 3-(4-Methylphenyl)-3-Oxo-Propanenitrile; 3-Keto-3-(4-Methylphenyl)Propionitrile; 4-Toluoylacetonitrile
Molecular Structure CAS#: 7391-28-8, 4-Methyl-beta-Oxo-Benzenepropanenitrile
Molecular Formula C10H9NO
Molecular Weight 159.19
CAS Registry Number 7391-28-8
SMILES C1=C(C=CC(=C1)C)C(=O)CC#N
InChI 1S/C10H9NO/c1-8-2-4-9(5-3-8)10(12)6-7-11/h2-5H,6H2,1H3
InChIKey AIECDYDQPCANJK-UHFFFAOYSA-N
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