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#33;(2R*,3S*,5R*)-(+/-)-5-[[(1,1-DIMETHYLETHYL)-DIMETHYLSILYL]-OXY]-2-[(4-FLOUROPHENOXY)-THIOCARBONYLOXY]-3-(METHOXYMETHOXY)-6-OCTYN-1-YL-2,2-DIMETHYLPROPIONAT
SpectraBase Compound ID K4owdbQGo5N
InChI InChI=1S/C35H49FO8SSi/c1-34(2,3)32(37)40-24-31(43-33(45)42-28-19-17-27(36)18-20-28)30(41-25-38-7)22-29(44-46(8,9)35(4,5)6)16-13-21-39-23-26-14-11-10-12-15-26/h10-12,14-15,17-20,29-31H,21-25H2,1-9H3/t29-,30+,31-/m1/s1
InChIKey RCAPOOIQTQLHCC-MJSOWUPRSA-N
Mol Weight 676.9 g/mol
Molecular Formula C35H49FO8SSi
Exact Mass 676.290144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpK3yInpfad
Name #33;(2R*,3S*,5R*)-(+/-)-5-[[(1,1-DIMETHYLETHYL)-DIMETHYLSILYL]-OXY]-2-[(4-FLOUROPHENOXY)-THIOCARBONYLOXY]-3-(METHOXYMETHOXY)-6-OCTYN-1-YL-2,2-DIMETHYLPROPIONAT
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H49FO8SSi
InChI InChI=1S/C35H49FO8SSi/c1-34(2,3)32(37)40-24-31(43-33(45)42-28-19-17-27(36)18-20-28)30(41-25-38-7)22-29(44-46(8,9)35(4,5)6)16-13-21-39-23-26-14-11-10-12-15-26/h10-12,14-15,17-20,29-31H,21-25H2,1-9H3/t29-,30+,31-/m1/s1
InChIKey RCAPOOIQTQLHCC-MJSOWUPRSA-N
Literature Reference Author M.SANNIGRAHI,D.L.MAYHEW,D.L.J.CLIVE
Literature Reference Citation J.ORG.CHEM.,64,2776(1999)
Literature Reference DOI 10.1021/jo982225m
Molecular Weight 676.913 g/mol
Sample ID 58799
Solvent CDCl3