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4-(hexacylthio)metanilic acid, potassium salt
SpectraBase Compound ID DSOaCQiWpHo
InChI InChI=1S/C22H39NO3S2.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-27-22-17-16-20(19-21(22)23)28(24,25)26;/h16-17,19H,2-15,18,23H2,1H3,(H,24,25,26);/q;+1/p-1
InChIKey VHJNMFYBANEMGB-UHFFFAOYSA-M
Mol Weight 467.7683 g/mol
Molecular Formula C22H38KNO3S2
Exact Mass 467.193018 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71OjgwaYn7
Name 4-(hexacylthio)metanilic acid, potassium salt
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Formula C22H38KNO3S2
InChI InChI=1S/C22H39NO3S2.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-27-22-17-16-20(19-21(22)23)28(24,25)26;/h16-17,19H,2-15,18,23H2,1H3,(H,24,25,26);/q;+1/p-1
InChIKey VHJNMFYBANEMGB-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 31233M
Solvent CDCl3