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2-(2,6-dimethylphenyl)-2-(phenylsulfonyl)ethanenitrile
SpectraBase Compound ID KmOP2lo75qA
InChI InChI=1S/C16H15NO2S/c1-12-7-6-8-13(2)16(12)15(11-17)20(18,19)14-9-4-3-5-10-14/h3-10,15H,1-2H3
InChIKey QYBWOVIEYMCHEJ-UHFFFAOYSA-N
Mol Weight 285.36 g/mol
Molecular Formula C16H15NO2S
Exact Mass 285.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RjqsenC4sP
Name 2-(2,6-dimethylphenyl)-2-(phenylsulfonyl)ethanenitrile
Alternate Name(s) 2-(benzenesulfonyl)-2-(2,6-dimethylphenyl)acetonitrile 2-besyl-2-(2,6-dimethylphenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO2S
InChI InChI=1S/C16H15NO2S/c1-12-7-6-8-13(2)16(12)15(11-17)20(18,19)14-9-4-3-5-10-14/h3-10,15H,1-2H3
InChIKey QYBWOVIEYMCHEJ-UHFFFAOYSA-N
Molecular Weight 285.361 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(c1c(cccc1C)C)C#N
SPLASH splash10-0006-0900000000-cf83a95005c4241fc751
Source of Spectrum KC-1993-297-10
Wiley ID 778795