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1-(Diphenylphosphinyl)thio-alpha,alpha,alpha-trifluoro-p-formotoluidide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

1-(Diphenylphosphinyl)thio-alpha,alpha,alpha-trifluoro-p-formotoluidide
SpectraBase Compound ID FKOrFnq106q
InChI InChI=1S/C20H15F3NOPS/c21-20(22,23)15-11-13-16(14-12-15)24-19(27)26(25,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14H,(H,24,27)
InChIKey YWQXZTWJYHHDHR-UHFFFAOYSA-N
Mol Weight 405.37 g/mol
Molecular Formula C20H15F3NOPS
Exact Mass 405.056407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 57PENpCmUph
Name 1-(Diphenylphosphinyl)thio-alpha,alpha,alpha-trifluoro-p-formotoluidide
Comments Computed using HOSE algorithm
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Exact Mass 405.056406767 u
Formula C20H15F3NOPS
InChI InChI=1S/C20H15F3NOPS/c21-20(22,23)15-11-13-16(14-12-15)24-19(27)26(25,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14H,(H,24,27)
InChIKey YWQXZTWJYHHDHR-UHFFFAOYSA-N
Molecular Weight 405.375 g/mol
SMILES N(C1=CC=C(C=C1)C(F)(F)F)C(P(=O)(C=1C=CC=CC1)C=1C=CC=CC1)=S