John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=3Uj2IgzeYnv SpectraBase Spectrum ID=2VeDX4bRSDm

(accessed ).
METHYL-4-O-ACETYL-3-O-BENZOYL-2,6-O-DI-(TOLUENE-P-SULFONYL)-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 3Uj2IgzeYnv
InChI InChI=1S/C30H32O12S2/c1-19-10-14-23(15-11-19)43(33,34)38-18-25-26(39-21(3)31)27(41-29(32)22-8-6-5-7-9-22)28(30(37-4)40-25)42-44(35,36)24-16-12-20(2)13-17-24/h5-17,25-28,30H,18H2,1-4H3/t25-,26-,27+,28-,30+/m1/s1
InChIKey XRSXYZWYFRJTBU-IXMSMLDRSA-N
Mol Weight 648.7 g/mol
Molecular Formula C30H32O12S2
Exact Mass 648.13352 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VeDX4bRSDm
Name METHYL-4-O-ACETYL-3-O-BENZOYL-2,6-O-DI-(TOLUENE-P-SULFONYL)-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 12
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32O12S2
InChI InChI=1S/C30H32O12S2/c1-19-10-14-23(15-11-19)43(33,34)38-18-25-26(39-21(3)31)27(41-29(32)22-8-6-5-7-9-22)28(30(37-4)40-25)42-44(35,36)24-16-12-20(2)13-17-24/h5-17,25-28,30H,18H2,1-4H3/t25-,26-,27+,28-,30+/m1/s1
InChIKey XRSXYZWYFRJTBU-IXMSMLDRSA-N
Literature Reference Author R.BLATTNER,R.H.FURNEAUX,T.KEMMITT,P.C.TYLER,R.J.FERRIER,A.K. TIDEN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3411(1994)
Literature Reference DOI 10.1039/p19940003411
Molecular Weight 648.697 g/mol
Solvent CDCl3
Source File Reference UWRU4416
SpectraBase Batch ID 6TDy2RSvAss