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4-METHYLPHENYL-2,3,4,6-TETRA-O-ACETYL-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID FxGFSq2V5ak
InChI InChI=1S/C21H26O9S/c1-11-6-8-16(9-7-11)31-21-20(29-15(5)25)19(28-14(4)24)18(27-13(3)23)17(30-21)10-26-12(2)22/h6-9,17-21H,10H2,1-5H3/t17-,18-,19+,20-,21-/m1/s1
InChIKey XRFOIRMXQHXTRL-YMQHIKHWSA-N
Mol Weight 454.49 g/mol
Molecular Formula C21H26O9S
Exact Mass 454.129754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9R4ivFfcGh
Name 4-METHYLPHENYL-2,3,4,6-TETRA-O-ACETYL-1-THIO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O9S
InChI InChI=1S/C21H26O9S/c1-11-6-8-16(9-7-11)31-21-20(29-15(5)25)19(28-14(4)24)18(27-13(3)23)17(30-21)10-26-12(2)22/h6-9,17-21H,10H2,1-5H3/t17-,18-,19+,20-,21-/m1/s1
InChIKey XRFOIRMXQHXTRL-YMQHIKHWSA-N
Literature Reference Author J.A.WATT,C.T.GANNON,K.J.LOFT,Z.DINEV,S.J.WILLIAMS
Literature Reference Citation AUSTR.J.CHEM.,61,837(2008)
Literature Reference DOI 10.1071/ch08364
Molecular Weight 454.492 g/mol
Sample ID 52765
Solvent CDCl3