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4-[Chloro(p-tolylsulfonyl)methyl]-1-naphthonitrile
SpectraBase Compound ID H56j8XfiSeY
InChI InChI=1S/C19H14ClNO2S/c1-13-6-9-15(10-7-13)24(22,23)19(20)18-11-8-14(12-21)16-4-2-3-5-17(16)18/h2-11,19H,1H3
InChIKey BPBNQUIIIPTVBQ-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 4Qy9DAFW5Dd
Name 4-[Chloro(p-tolylsulfonyl)methyl]-1-naphthonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14ClNO2S
InChI InChI=1S/C19H14ClNO2S/c1-13-6-9-15(10-7-13)24(22,23)19(20)18-11-8-14(12-21)16-4-2-3-5-17(16)18/h2-11,19H,1H3
InChIKey BPBNQUIIIPTVBQ-UHFFFAOYSA-N
Molecular Weight 355.839 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(c1c2c(cccc2)c(C#N)cc1)Cl
SPLASH splash10-0udi-1290000000-ce73d96965999371e0f6
Source of Spectrum KC-0-1095-13
Synonyms 4-{chloro[(4-methylphenyl)sulfonyl]methyl}-1-naphthonitrile
Wiley ID 820798