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N-[4-Amino-5-cyano-3-phenyl-6-(trichloromethyl)pyridin-2-yl]-4-methylbenzenesulfonamide
SpectraBase Compound ID HPlQKDp4I2O
InChI InChI=1S/C20H15Cl3N4O2S/c1-12-7-9-14(10-8-12)30(28,29)27-19-16(13-5-3-2-4-6-13)17(25)15(11-24)18(26-19)20(21,22)23/h2-10H,1H3,(H3,25,26,27)
InChIKey YYDXNWURXZFEAD-UHFFFAOYSA-N
Mol Weight 481.79 g/mol
Molecular Formula C20H15Cl3N4O2S
Exact Mass 479.99813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7aLfPPhl9h7
Name N-[4-Amino-5-cyano-3-phenyl-6-(trichloromethyl)pyridin-2-yl]-4-methylbenzenesulfonamide
Appearance Cream powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15Cl3N4O2S
InChI InChI=1S/C20H15Cl3N4O2S/c1-12-7-9-14(10-8-12)30(28,29)27-19-16(13-5-3-2-4-6-13)17(25)15(11-24)18(26-19)20(21,22)23/h2-10H,1H3,(H3,25,26,27)
InChIKey YYDXNWURXZFEAD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3668
Molecular Weight 481.785 g/mol
SMILES Nc1c(c(nc(c1C#N)C(Cl)(Cl)Cl)NS(=O)(c1ccc(cc1)C)=O)-c1ccccc1
SPLASH splash10-05fr-3902000000-d9223dbb5a12366dfa1b
Source of Spectrum Y-56-2608-6a
Wiley ID 1859661