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2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-ISOTHIOURONIUM-BROMIDE
SpectraBase Compound ID ARTHVMsl8Qw
InChI InChI=1S/C15H22N2O9S.BrH/c1-6(18)22-5-10-11(23-7(2)19)12(24-8(3)20)13(25-9(4)21)14(26-10)27-15(16)17;/h10-14H,5H2,1-4H3,(H3,16,17);1H/t10-,11-,12+,13-,14+;/m1./s1
InChIKey QNVDHERXTIAGPT-SXQUUHMTSA-N
Mol Weight 487.32 g/mol
Molecular Formula C15H23BrN2O9S
Exact Mass 486.030764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9kZzYh09Dqf
Name 2,3,4,6-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-ISOTHIOURONIUM-BROMIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H23BrN2O9S
InChI InChI=1S/C15H22N2O9S.BrH/c1-6(18)22-5-10-11(23-7(2)19)12(24-8(3)20)13(25-9(4)21)14(26-10)27-15(16)17;/h10-14H,5H2,1-4H3,(H3,16,17);1H/t10-,11-,12+,13-,14+;/m1./s1
InChIKey QNVDHERXTIAGPT-SXQUUHMTSA-N
Literature Reference Author M.L.UHRIG,V.E.MANZANO,O.VARELA
Literature Reference Citation EUR.J.ORG.CHEM.,162(2006)
Molecular Weight 487.320 g/mol
Sample ID 42755
Solvent DMSO-D6