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4-Chloro-2-(p-tolylsulfonylmethyl)-1-naphthonitrile
SpectraBase Compound ID LRHD3JkyVt5
InChI InChI=1S/C19H14ClNO2S/c1-13-6-8-15(9-7-13)24(22,23)12-14-10-19(20)17-5-3-2-4-16(17)18(14)11-21/h2-10H,12H2,1H3
InChIKey MFMPRBUJUKXMPX-UHFFFAOYSA-N
Mol Weight 355.84 g/mol
Molecular Formula C19H14ClNO2S
Exact Mass 355.043378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbuQRe8xWUi
Name 4-Chloro-2-(p-tolylsulfonylmethyl)-1-naphthonitrile
Alternate Name(s) 4-Chloro-2-{[(4-methylphenyl)sulfonyl]methyl}-1-naphthonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14ClNO2S
InChI InChI=1S/C19H14ClNO2S/c1-13-6-8-15(9-7-13)24(22,23)12-14-10-19(20)17-5-3-2-4-16(17)18(14)11-21/h2-10H,12H2,1H3
InChIKey MFMPRBUJUKXMPX-UHFFFAOYSA-N
Molecular Weight 355.839 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)c1c(c2ccccc2c(c1)Cl)C#N
SPLASH splash10-0udi-4391000000-629e4a04ea9df686c1d1
Source of Spectrum KC-0-1096-17
Wiley ID 820796