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DICYCLOHEXYLMETHYL_2,3,6-TRIO-BENZYL-1-THIO-ALPHA-D-GLUCOPYRANOSIDE

View entire compound with spectra: 1 NMR

DICYCLOHEXYLMETHYL_2,3,6-TRIO-BENZYL-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID Ego8nwc5V8l
InChI InChI=1S/C40H52O5S/c41-36-35(29-42-26-30-16-6-1-7-17-30)45-40(46-39(33-22-12-4-13-23-33)34-24-14-5-15-25-34)38(44-28-32-20-10-3-11-21-32)37(36)43-27-31-18-8-2-9-19-31/h1-3,6-11,16-21,33-41H,4-5,12-15,22-29H2/t35-,36-,37+,38-,40-/m0/s1
InChIKey RNDOJLKBRXWOFK-SQORGUJYSA-N
Mol Weight 644.9 g/mol
Molecular Formula C40H52O5S
Exact Mass 644.353546 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 355JKR4tkKL
Name DICYCLOHEXYLMETHYL_2,3,6-TRIO-BENZYL-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H52O5S
InChI InChI=1S/C40H52O5S/c41-36-35(29-42-26-30-16-6-1-7-17-30)45-40(46-39(33-22-12-4-13-23-33)34-24-14-5-15-25-34)38(44-28-32-20-10-3-11-21-32)37(36)43-27-31-18-8-2-9-19-31/h1-3,6-11,16-21,33-41H,4-5,12-15,22-29H2/t35-,36-,37+,38-,40-/m0/s1
InChIKey RNDOJLKBRXWOFK-SQORGUJYSA-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 644.910 g/mol
Solvent CDCl3
Source File Reference UWMZ5274