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DICYCLOHEXYLMETHYL_2,3-DI-O-BENZOYL-4,6-O-BENZYLIDENE-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Jd49CslgGNf
InChI InChI=1S/C40H46O7S/c41-37(29-20-10-3-11-21-29)45-34-33-32(26-43-39(47-33)31-24-14-5-15-25-31)44-40(35(34)46-38(42)30-22-12-4-13-23-30)48-36(27-16-6-1-7-17-27)28-18-8-2-9-19-28/h3-5,10-15,20-25,27-28,32-36,39-40H,1-2,6-9,16-19,26H2/t32-,33-,34+,35-,39?,40-/m0/s1
InChIKey KHARGMOAZLNCIT-IDLJHYGSSA-N
Mol Weight 670.9 g/mol
Molecular Formula C40H46O7S
Exact Mass 670.296425 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2iT6mxMLop4
Name DICYCLOHEXYLMETHYL_2,3-DI-O-BENZOYL-4,6-O-BENZYLIDENE-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46O7S
InChI InChI=1S/C40H46O7S/c41-37(29-20-10-3-11-21-29)45-34-33-32(26-43-39(47-33)31-24-14-5-15-25-31)44-40(35(34)46-38(42)30-22-12-4-13-23-30)48-36(27-16-6-1-7-17-27)28-18-8-2-9-19-28/h3-5,10-15,20-25,27-28,32-36,39-40H,1-2,6-9,16-19,26H2/t32-,33-,34+,35-,39?,40-/m0/s1
InChIKey KHARGMOAZLNCIT-IDLJHYGSSA-N
Literature Reference Author R.GEURTSEN,D.S.HOLMES,G.J.BOONS
Literature Reference Citation J.ORG.CHEM.,62,8145(1997)
Literature Reference DOI 10.1021/jo971233k
Molecular Weight 670.861 g/mol
Solvent CDCl3
Source File Reference UWMZ5273