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p,p-Dimethyl-p-[2-(2,6-dimethylphenylamino)-phenyl]-p-phenyl-phosphonium-triflate
SpectraBase Compound ID 8IFsYulZ4gw
InChI InChI=1S/C22H25NP.CHF3O3S/c1-17-11-10-12-18(2)22(17)23-20-15-8-9-16-21(20)24(3,4)19-13-6-5-7-14-19;2-1(3,4)8(5,6)7/h5-16,23H,1-4H3;(H,5,6,7)/q+1;/p-1
InChIKey PCUVVKBHJIHCFT-UHFFFAOYSA-M
Mol Weight 483.49 g/mol
Molecular Formula C23H25F3NO3PS
Exact Mass 483.124486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdytjTfBXB
Name p,p-Dimethyl-p-[2-(2,6-dimethylphenylamino)-phenyl]-p-phenyl-phosphonium-triflate
Comments Computed using HOSE algorithm
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Exact Mass 483.124486327 u
Formula C23H25F3NO3PS
InChI InChI=1S/C22H25NP.CHF3O3S/c1-17-11-10-12-18(2)22(17)23-20-15-8-9-16-21(20)24(3,4)19-13-6-5-7-14-19;2-1(3,4)8(5,6)7/h5-16,23H,1-4H3;(H,5,6,7)/q+1;/p-1
InChIKey PCUVVKBHJIHCFT-UHFFFAOYSA-M
Molecular Weight 483.486 g/mol
SMILES C(S(=O)([O-])=O)(F)(F)F.C1(NC2=C(C=CC=C2C)C)=C([P+](C)(C)C2=CC=CC=C2)C=CC=C1