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(-)-TRIETHYL-[(Z)-(1R,2R)-2-CYCLOHEXYL-4-[(S)-N-METHYL-S-PHENYL-SULFONIMIDOYL]-1-PHENYLETHYNYL-BUT-3-ENYLOXY]-SILANE
SpectraBase Compound ID 72ZGtRBsKYt
InChI InChI=1S/C31H43NO2SSi/c1-5-36(6-2,7-3)34-31(24-23-27-17-11-8-12-18-27)30(28-19-13-9-14-20-28)25-26-35(33,32-4)29-21-15-10-16-22-29/h8,10-12,15-18,21-22,25-26,28,30-31H,5-7,9,13-14,19-20H2,1-4H3/b26-25-/t30-,31+,35?/m1/s1
InChIKey AFXPBGLPECVQTO-TUSHTDQUSA-N
Mol Weight 521.8 g/mol
Molecular Formula C31H43NO2SSi
Exact Mass 521.278377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DeIRDCmkgcI
Name (-)-TRIETHYL-[(Z)-(1R,2R)-2-CYCLOHEXYL-4-[(S)-N-METHYL-S-PHENYL-SULFONIMIDOYL]-1-PHENYLETHYNYL-BUT-3-ENYLOXY]-SILANE
Compound Number 6I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43NO2SSi
InChI InChI=1S/C31H43NO2SSi/c1-5-36(6-2,7-3)34-31(24-23-27-17-11-8-12-18-27)30(28-19-13-9-14-20-28)25-26-35(33,32-4)29-21-15-10-16-22-29/h8,10-12,15-18,21-22,25-26,28,30-31H,5-7,9,13-14,19-20H2,1-4H3/b26-25-/t30-,31+,35?/m1/s1
InChIKey AFXPBGLPECVQTO-TUSHTDQUSA-N
Literature Reference Author L.R.REDDY,H.J.GAIS,C.W.WOO,G.RAABE
Literature Reference Citation J.AM.CHEM.SOC.,124,10427(2002)
Literature Reference DOI 10.1021/ja020570u
Molecular Weight 521.833 g/mol
Sample ID 49043
Solvent CDCl3