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DICYCLOHEXYLMETHYL_2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID ENPbQDfPGaB
InChI InChI=1S/C27H42O9S/c1-16(28)32-15-22-23(33-17(2)29)24(34-18(3)30)25(35-19(4)31)27(36-22)37-26(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h20-27H,5-15H2,1-4H3/t22-,23-,24+,25-,27+/m1/s1
InChIKey JRWLMPRKDSLJSZ-NUPXYHBHSA-N
Mol Weight 542.7 g/mol
Molecular Formula C27H42O9S
Exact Mass 542.254954 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7hTYyUcP9Tf
Name DICYCLOHEXYLMETHYL_2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GLUCOPYRANOSIDE
Compound Number 1-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O9S
InChI InChI=1S/C27H42O9S/c1-16(28)32-15-22-23(33-17(2)29)24(34-18(3)30)25(35-19(4)31)27(36-22)37-26(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h20-27H,5-15H2,1-4H3/t22-,23-,24+,25-,27+/m1/s1
InChIKey JRWLMPRKDSLJSZ-NUPXYHBHSA-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 542.685 g/mol
Solvent CDCl3
Source File Reference UWMZ5251