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2-(3-Methylphenyl)-2-(phenylsulfonyl)ethanenitrile
SpectraBase Compound ID BbE6clCnQMr
InChI InChI=1S/C15H13NO2S/c1-12-6-5-7-13(10-12)15(11-16)19(17,18)14-8-3-2-4-9-14/h2-10,15H,1H3
InChIKey RBBZHEJHCMQMSK-UHFFFAOYSA-N
Mol Weight 271.33 g/mol
Molecular Formula C15H13NO2S
Exact Mass 271.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KQKPJphAEZU
Name 2-(3-Methylphenyl)-2-(phenylsulfonyl)ethanenitrile
Alternate Name(s) 2-(benzenesulfonyl)-2-(3-methylphenyl)acetonitrile 2-(benzenesulfonyl)-2-(m-tolyl)acetonitrile 2-besyl-2-(m-tolyl)acetonitrile
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Formula C15H13NO2S
InChI InChI=1S/C15H13NO2S/c1-12-6-5-7-13(10-12)15(11-16)19(17,18)14-8-3-2-4-9-14/h2-10,15H,1H3
InChIKey RBBZHEJHCMQMSK-UHFFFAOYSA-N
Molecular Weight 271.334 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(c1cc(C)ccc1)C#N
SPLASH splash10-001i-1910000000-1bd0d6e636401eb0b278
Source of Spectrum KC-1993-297-6
Wiley ID 778801