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Methyl 3-O-methyl-2,4,6-tris(O-[4-bromo-benzoyl]).alpha.-D-glucopyranoside

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Methyl 3-O-methyl-2,4,6-tris(O-[4-bromo-benzoyl]).alpha.-D-glucopyranoside
SpectraBase Compound ID 7bhMTE2E3Ky
InChI InChI=1S/C29H25Br3O9/c1-36-24-23(40-27(34)17-5-11-20(31)12-6-17)22(15-38-26(33)16-3-9-19(30)10-4-16)39-29(37-2)25(24)41-28(35)18-7-13-21(32)14-8-18/h3-14,22-25,29H,15H2,1-2H3/t22-,23-,24+,25-,29+/m1/s1
InChIKey NRJBWJHVZSFORH-YVXTWPRQSA-N
Mol Weight 757.22 g/mol
Molecular Formula C29H25Br3O9
Exact Mass 753.904871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FJza7J1dpIC
Name Methyl 3-O-methyl-2,4,6-tris(O-[4-bromo-benzoyl]).alpha.-D-glucopyranoside
CAS Registry Number 78950-14-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H25Br3O9
InChI InChI=1S/C29H25Br3O9/c1-36-24-23(40-27(34)17-5-11-20(31)12-6-17)22(15-38-26(33)16-3-9-19(30)10-4-16)39-29(37-2)25(24)41-28(35)18-7-13-21(32)14-8-18/h3-14,22-25,29H,15H2,1-2H3/t22-,23-,24+,25-,29+/m1/s1
InChIKey NRJBWJHVZSFORH-YVXTWPRQSA-N
Instrument Name Bruker WM-250
Literature Reference H.W. Liu, K. Nakanishi, J. Am. Chem. Soc. 104, 1178 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3