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N-[4-Amino-3-butyl-5-cyano-6-(trichloromethyl)pyridin-2-yl]methanesulfonamide
SpectraBase Compound ID LircRmLUk53
InChI InChI=1S/C12H15Cl3N4O2S/c1-3-4-5-7-9(17)8(6-16)10(12(13,14)15)18-11(7)19-22(2,20)21/h3-5H2,1-2H3,(H3,17,18,19)
InChIKey FOTHBYAOMYICGF-UHFFFAOYSA-N
Mol Weight 385.7 g/mol
Molecular Formula C12H15Cl3N4O2S
Exact Mass 383.99813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KXewSw2441k
Name N-[4-Amino-3-butyl-5-cyano-6-(trichloromethyl)pyridin-2-yl]methanesulfonamide
Appearance Cream powder
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Formula C12H15Cl3N4O2S
InChI InChI=1S/C12H15Cl3N4O2S/c1-3-4-5-7-9(17)8(6-16)10(12(13,14)15)18-11(7)19-22(2,20)21/h3-5H2,1-2H3,(H3,17,18,19)
InChIKey FOTHBYAOMYICGF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3668
Molecular Weight 385.697 g/mol
SMILES Nc1c(c(nc(c1C#N)C(Cl)(Cl)Cl)NS(=O)(C)=O)CCCC
SPLASH splash10-066u-5925000000-7e904267a2df628b4b5b
Source of Spectrum Y-56-2609-6g
Wiley ID 1859667