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4-(TRITYLMERCAPTOACETAMIDE)-PHENYL-ALPHA-D-GALACTOPYRANOSIDE
SpectraBase Compound ID BYWbsCDwS8A
InChI InChI=1S/C33H33NO7S/c35-20-27-29(37)30(38)31(39)32(41-27)40-26-18-16-25(17-19-26)34-28(36)21-42-33(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19,27,29-32,35,37-39H,20-21H2,(H,34,36)/t27-,29+,30+,31-,32+/m0/s1
InChIKey YXGUKLULEXAIJN-DPLCPDDWSA-N
Mol Weight 587.7 g/mol
Molecular Formula C33H33NO7S
Exact Mass 587.197774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LEfkmif3ANY
Name 4-(TRITYLMERCAPTOACETAMIDE)-PHENYL-ALPHA-D-GALACTOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H33NO7S
InChI InChI=1S/C33H33NO7S/c35-20-27-29(37)30(38)31(39)32(41-27)40-26-18-16-25(17-19-26)34-28(36)21-42-33(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-19,27,29-32,35,37-39H,20-21H2,(H,34,36)/t27-,29+,30+,31-,32+/m0/s1
InChIKey YXGUKLULEXAIJN-DPLCPDDWSA-N
Literature Reference Author J.BRASK,H.WACKERBARTH,K.J.JENSEN,J.ZHANG,I.CHORKENDORFF,J.UL STRUP
Literature Reference Citation J.AM.CHEM.SOC.,125,94(2003)
Literature Reference DOI 10.1021/ja020943r
Molecular Weight 587.688 g/mol
Sample ID 40301
Solvent DMSO-D6