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Sulindac sulfide, tert-butyldimethylsilyl ester
SpectraBase Compound ID G9cPHyK1kK0
InChI InChI=1S/C26H31FO2SSi/c1-17-22(14-18-8-11-20(30-5)12-9-18)21-13-10-19(27)15-24(21)23(17)16-25(28)29-31(6,7)26(2,3)4/h8-15H,16H2,1-7H3/b22-14-
InChIKey QJRZEFNRWYCJJE-HMAPJEAMSA-N
Mol Weight 454.68 g/mol
Molecular Formula C26H31FO2SSi
Exact Mass 454.179806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CuOa8vsfm4N
Name Sulindac sulfide, tert-butyldimethylsilyl ester
Comments Computed using HOSE algorithm
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Exact Mass 454.179806108 u
Formula C26H31FO2SSi
InChI InChI=1S/C26H31FO2SSi/c1-17-22(14-18-8-11-20(30-5)12-9-18)21-13-10-19(27)15-24(21)23(17)16-25(28)29-31(6,7)26(2,3)4/h8-15H,16H2,1-7H3/b22-14-
InChIKey QJRZEFNRWYCJJE-HMAPJEAMSA-N
Molecular Weight 454.675 g/mol
SMILES CSC1=CC=C(C=C1)\C=C/1C2=C(C=C(F)C=C2)C(=C1C)CC(=O)O[Si](C)(C)C(C)(C)C