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4-(p-fluorophenyl)-5-veratryl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID AU2PG5fIZdg
InChI InChI=1S/C17H16FN3O2S/c1-22-14-8-3-11(9-15(14)23-2)10-16-19-20-17(24)21(16)13-6-4-12(18)5-7-13/h3-9H,10H2,1-2H3,(H,20,24)
InChIKey VFRKPULLDCTBSL-UHFFFAOYSA-N
Mol Weight 345.39 g/mol
Molecular Formula C17H16FN3O2S
Exact Mass 345.094726 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CWcSpJW6OvR
Name 4-(p-fluorophenyl)-5-veratryl-4H-1,2,4-triazole-3-thiol
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Formula C17H16FN3O2S
InChI InChI=1S/C17H16FN3O2S/c1-22-14-8-3-11(9-15(14)23-2)10-16-19-20-17(24)21(16)13-6-4-12(18)5-7-13/h3-9H,10H2,1-2H3,(H,20,24)
InChIKey VFRKPULLDCTBSL-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 46244M
Solvent CDCl3