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5-(META-CHLOROBENZOYL)-3-C-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL)-1,2,4-OXADIAZOLE
SpectraBase Compound ID 6vDkq5ZYY8p
InChI InChI=1S/C42H31ClN2O10/c43-31-23-13-22-30(24-31)38-44-37(45-55-38)36-35(54-42(49)29-20-11-4-12-21-29)34(53-41(48)28-18-9-3-10-19-28)33(52-40(47)27-16-7-2-8-17-27)32(51-36)25-50-39(46)26-14-5-1-6-15-26/h1-24,32-36H,25H2/t32-,33-,34+,35-,36-/m0/s1
InChIKey DYLNZPBTRMUOGB-AGEXMYHWSA-N
Mol Weight 759.2 g/mol
Molecular Formula C42H31ClN2O10
Exact Mass 758.166723 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4txtE5Guzoa
Name 5-(META-CHLOROBENZOYL)-3-C-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL)-1,2,4-OXADIAZOLE
Compound Number 8F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H31ClN2O10
InChI InChI=1S/C42H31ClN2O10/c43-31-23-13-22-30(24-31)38-44-37(45-55-38)36-35(54-42(49)29-20-11-4-12-21-29)34(53-41(48)28-18-9-3-10-19-28)33(52-40(47)27-16-7-2-8-17-27)32(51-36)25-50-39(46)26-14-5-1-6-15-26/h1-24,32-36H,25H2/t32-,33-,34+,35-,36-/m0/s1
InChIKey DYLNZPBTRMUOGB-AGEXMYHWSA-N
Literature Reference Author M.BENLTIFA,S.VIDAL,B.FENET,M.MSADDEK,P.G.GOEKJIAN,J.P.PRALY, A.BRUNYANSZKI,T.DOCS
Literature Reference Citation EUR.J.ORG.CHEM.,4242(2006)
Molecular Weight 759.169 g/mol
Sample ID 32877
Solvent CDCl3