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Benzeneacetonitrile, 3-benzoyl-.alpha.-methyl-
SpectraBase Compound ID DmRjiHHtadB
InChI InChI=1S/C16H13NO/c1-12(11-17)14-8-5-9-15(10-14)16(18)13-6-3-2-4-7-13/h2-10,12H,1H3
InChIKey RGYOCHMZSLUCNP-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C16H13NO
Exact Mass 235.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCdy4DoHgii
Name Benzeneacetonitrile, 3-benzoyl-.alpha.-methyl-
CAS Registry Number 42872-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO
InChI InChI=1S/C16H13NO/c1-12(11-17)14-8-5-9-15(10-14)16(18)13-6-3-2-4-7-13/h2-10,12H,1H3
InChIKey RGYOCHMZSLUCNP-UHFFFAOYSA-N
Molecular Weight 235.286 g/mol
SMILES CC(C#N)c1cccc(c1)C(c1ccccc1)=O
SPLASH splash10-0a4i-3920000000-aba3043bc1d087cbe91b
Source of Spectrum JZ-1992-4505-0
Synonyms 2-(3-Benzoylphenyl)propanenitrile 2-(3-Benzoylphenyl)propionitrile 2-(m-Benzoylphenyl)propionitrile 2-[3-(Phenylcarbonyl)phenyl]propanenitrile BRN 2844731 EINECS 255-982-5
Wiley ID 1237332