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3-[6-methyl-4-(trifluoromethyl)-2-pyridyl]-N-(phenylsulfonyl)thiocarbazimidic acid, methyl ester
SpectraBase Compound ID fpKl6dFD4a
InChI InChI=1S/C15H15F3N4O2S2/c1-10-8-11(15(16,17)18)9-13(19-10)20-21-14(25-2)22-26(23,24)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,20)(H,21,22)
InChIKey OIGXYRCTZJAAPA-UHFFFAOYSA-N
Mol Weight 404.43 g/mol
Molecular Formula C15H15F3N4O2S2
Exact Mass 404.058853 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9i8MMRrPDh7
Name 3-[6-methyl-4-(trifluoromethyl)-2-pyridyl]-N-(phenylsulfonyl)thiocarbazimidic acid, methyl ester
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Formula C15H15F3N4O2S2
InChI InChI=1S/C15H15F3N4O2S2/c1-10-8-11(15(16,17)18)9-13(19-10)20-21-14(25-2)22-26(23,24)12-6-4-3-5-7-12/h3-9H,1-2H3,(H,19,20)(H,21,22)
InChIKey OIGXYRCTZJAAPA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 57165M
Solvent Polysol