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2,2',3,3',4',6,6'-HEPTA-O-ACETYL-1-S-ACETYL-1-THIO-ALPHA-MALTOSE
SpectraBase Compound ID L5TDNT1kUhG
InChI InChI=1S/C28H38O18S/c1-11(29)37-9-19-21(39-13(3)31)23(40-14(4)32)25(42-16(6)34)27(44-19)46-22-20(10-38-12(2)30)45-28(47-18(8)36)26(43-17(7)35)24(22)41-15(5)33/h19-28H,9-10H2,1-8H3/t19-,20-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1
InChIKey FRXVJYSARLMCLR-QACPWNKNSA-N
Mol Weight 694.7 g/mol
Molecular Formula C28H38O18S
Exact Mass 694.177886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRvriF3MZbG
Name 2,2',3,3',4',6,6'-HEPTA-O-ACETYL-1-S-ACETYL-1-THIO-ALPHA-MALTOSE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38O18S
InChI InChI=1S/C28H38O18S/c1-11(29)37-9-19-21(39-13(3)31)23(40-14(4)32)25(42-16(6)34)27(44-19)46-22-20(10-38-12(2)30)45-28(47-18(8)36)26(43-17(7)35)24(22)41-15(5)33/h19-28H,9-10H2,1-8H3/t19-,20-,21-,22-,23+,24+,25-,26-,27-,28-/m1/s1
InChIKey FRXVJYSARLMCLR-QACPWNKNSA-N
Literature Reference Author V.LAINE,A.COSTE-SARGUET,A.GADELLE,J.DEFAYE,B.PERLY,F.DJEDAIN I-PILARD
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1479(1995)
Literature Reference DOI 10.1039/p29950001479
Molecular Weight 694.659 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ2751