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N-[4-Amino-5-cyano-3-phenyl-6-(trichloromethyl)pyridin-2-yl]methanesulfonamide
SpectraBase Compound ID 4QzwPli6ck4
InChI InChI=1S/C14H11Cl3N4O2S/c1-24(22,23)21-13-10(8-5-3-2-4-6-8)11(19)9(7-18)12(20-13)14(15,16)17/h2-6H,1H3,(H3,19,20,21)
InChIKey LPNVRZDUAZBVJZ-UHFFFAOYSA-N
Mol Weight 405.69 g/mol
Molecular Formula C14H11Cl3N4O2S
Exact Mass 403.96683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RtL7rpeU7w
Name N-[4-Amino-5-cyano-3-phenyl-6-(trichloromethyl)pyridin-2-yl]methanesulfonamide
Appearance Cream powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11Cl3N4O2S
InChI InChI=1S/C14H11Cl3N4O2S/c1-24(22,23)21-13-10(8-5-3-2-4-6-8)11(19)9(7-18)12(20-13)14(15,16)17/h2-6H,1H3,(H3,19,20,21)
InChIKey LPNVRZDUAZBVJZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3668
Molecular Weight 405.687 g/mol
SMILES Nc1c(c(nc(c1C#N)C(Cl)(Cl)Cl)NS(=O)(C)=O)-c1ccccc1
SPLASH splash10-016r-3921000000-d3440806b8ab2959cb68
Source of Spectrum Y-56-2608-6c
Wiley ID 1859663