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5-O-BENZOYL-1,2-DI-O-ACETYL-3-O-METHANESULFONYL-ALPHA/BETA-D-XYLOFURANOSIDE;MIXTURE

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5-O-BENZOYL-1,2-DI-O-ACETYL-3-O-METHANESULFONYL-ALPHA/BETA-D-XYLOFURANOSIDE;MIXTURE
SpectraBase Compound ID 8gGFLrkY3N8
InChI InChI=1S/2C17H20O10S/c2*1-10(18)24-15-14(27-28(3,21)22)13(26-17(15)25-11(2)19)9-23-16(20)12-7-5-4-6-8-12/h2*4-8,13-15,17H,9H2,1-3H3/t13-,14+,15-,17+;13-,14+,15-,17-/m00/s1
InChIKey XAEHYXCVTPEIRL-OIBBVCKDSA-N
Mol Weight 832.79 g/mol
Molecular Formula C34H40O20S2
Exact Mass 832.155436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 89WM7SXNsAB
Name 5-O-BENZOYL-1,2-DI-O-ACETYL-3-O-METHANESULFONYL-ALPHA/BETA-D-XYLOFURANOSIDE;MIXTURE
Compound Number 12
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H40O20S2
InChI InChI=1S/2C17H20O10S/c2*1-10(18)24-15-14(27-28(3,21)22)13(26-17(15)25-11(2)19)9-23-16(20)12-7-5-4-6-8-12/h2*4-8,13-15,17H,9H2,1-3H3/t13-,14+,15-,17+;13-,14+,15-,17-/m00/s1
InChIKey XAEHYXCVTPEIRL-OIBBVCKDSA-N
Literature Reference Author R.R.GADIKOTA,C.S.CALLAM,T.WAGNER,B.D.FRAINO,T.L.LOWARY
Literature Reference Citation J.AM.CHEM.SOC.,125,4155(2003)
Literature Reference DOI 10.1021/ja029302m
Molecular Weight 832.800 g/mol
Sample ID 41535
Solvent CDCl3