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4-Chloro-N-[phenyl(cyano)methylene]-2-(phenylsulfonyl)methylaniline
SpectraBase Compound ID AnZ64qqwtWi
InChI InChI=1S/C21H15ClN2O2S/c22-18-11-12-20(24-21(14-23)16-7-3-1-4-8-16)17(13-18)15-27(25,26)19-9-5-2-6-10-19/h1-13H,15H2/b24-21-
InChIKey MCUGKOFBFTVZRZ-FLFQWRMESA-N
Mol Weight 394.88 g/mol
Molecular Formula C21H15ClN2O2S
Exact Mass 394.054277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pMXOWtV9i1
Name 4-Chloro-N-[phenyl(cyano)methylene]-2-(phenylsulfonyl)methylaniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15ClN2O2S
InChI InChI=1S/C21H15ClN2O2S/c22-18-11-12-20(24-21(14-23)16-7-3-1-4-8-16)17(13-18)15-27(25,26)19-9-5-2-6-10-19/h1-13H,15H2/b24-21-
InChIKey MCUGKOFBFTVZRZ-FLFQWRMESA-N
Molecular Weight 394.876 g/mol
SMILES C(S(=O)(=O)c1ccccc1)c1c(\N=C\(C#N)c2ccccc2)ccc(c1)Cl
SPLASH splash10-0udi-0191000000-07b5c02fcf85c6916f62
Source of Spectrum SO-0-988-6
Synonyms (2E)-({4-chloro-2-[(phenylsulfonyl)methyl]phenyl}imino)(phenyl)ethanenitrile
Wiley ID 875634