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2-(4-Methylphenyl)sulfinyl-2-triphenylphosphoranylideneacetic acid tert-butyl ester
SpectraBase Compound ID D8DwiAi19E
InChI InChI=1S/C31H31O3PS/c1-24-20-22-28(23-21-24)36(33)30(29(32)34-31(2,3)4)35(25-14-8-5-9-15-25,26-16-10-6-11-17-26)27-18-12-7-13-19-27/h5-23H,1-4H3
InChIKey MFGRAXOOZRRPJA-UHFFFAOYSA-N
Mol Weight 514.62 g/mol
Molecular Formula C31H31O3PS
Exact Mass 514.173153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6qOkFYCKB7m
Name 2-(4-Methylphenyl)sulfinyl-2-triphenylphosphoranylideneacetic acid tert-butyl ester
Alternate Name(s) 2-(p-tolylsulfinyl)-2-triphenylphosphoranylidene-acetic acid tert-butyl ester tert-Butyl 2-(4-methylphenyl)sulfinyl-2-(triphenyl-$l^{5}-phosphanylidene)acetate tert-Butyl 2-(p-tolylsulfinyl)-2-(triphenyl-$l^{5}-phosphanylidene)acetate
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Formula C31H31O3PS
InChI InChI=1S/C31H31O3PS/c1-24-20-22-28(23-21-24)36(33)30(29(32)34-31(2,3)4)35(25-14-8-5-9-15-25,26-16-10-6-11-17-26)27-18-12-7-13-19-27/h5-23H,1-4H3
InChIKey MFGRAXOOZRRPJA-UHFFFAOYSA-N
Molecular Weight 514.620 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(OC(C)(C)C)=O)S(c1ccc(cc1)C)=O
SPLASH splash10-004i-0290000000-35dbc0749915d29aee5a
Source of Spectrum KC-0-599-30
Wiley ID 827592