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1-(Diphenylphosphinyl)-3'-(methylthio)thioformanilide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

1-(Diphenylphosphinyl)-3'-(methylthio)thioformanilide
SpectraBase Compound ID K9YX81nWm4M
InChI InChI=1S/C20H18NOPS2/c1-25-19-14-8-9-16(15-19)21-20(24)23(22,17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-15H,1H3,(H,21,24)
InChIKey QHQFPBUUDJGNTA-UHFFFAOYSA-N
Mol Weight 383.46 g/mol
Molecular Formula C20H18NOPS2
Exact Mass 383.056744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uCm0iD5bYf
Name 1-(Diphenylphosphinyl)-3'-(methylthio)thioformanilide
Comments Computed using HOSE algorithm
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Exact Mass 383.056743549 u
Formula C20H18NOPS2
InChI InChI=1S/C20H18NOPS2/c1-25-19-14-8-9-16(15-19)21-20(24)23(22,17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-15H,1H3,(H,21,24)
InChIKey QHQFPBUUDJGNTA-UHFFFAOYSA-N
Molecular Weight 383.464 g/mol
SMILES N(C1=CC=CC(=C1)SC)C(P(C=1C=CC=CC1)(=O)C=1C=CC=CC1)=S