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BIS-(METHYL-4,6-O-BENZYLIDENE-3-DEOXY-ALPHA-D-MANNOPYRANOSIDE-3-YL)-HEXANEDIOATE
SpectraBase Compound ID I3RdJrfFoZT
InChI InChI=1S/C34H42O14/c1-39-33-25(37)29(27-21(43-33)17-41-31(47-27)19-11-5-3-6-12-19)45-23(35)15-9-10-16-24(36)46-30-26(38)34(40-2)44-22-18-42-32(48-28(22)30)20-13-7-4-8-14-20/h3-8,11-14,21-22,25-34,37-38H,9-10,15-18H2,1-2H3/t21-,22-,25+,26+,27-,28-,29-,30-,31-,32-,33+,34+/m0/s1
InChIKey CADLZOCXOZRFQH-BLSSCCJYSA-N
Mol Weight 674.7 g/mol
Molecular Formula C34H42O14
Exact Mass 674.257456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QMTBwizVBQ
Name BIS-(METHYL-4,6-O-BENZYLIDENE-3-DEOXY-ALPHA-D-MANNOPYRANOSIDE-3-YL)-HEXANEDIOATE
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H42O14
InChI InChI=1S/C34H42O14/c1-39-33-25(37)29(27-21(43-33)17-41-31(47-27)19-11-5-3-6-12-19)45-23(35)15-9-10-16-24(36)46-30-26(38)34(40-2)44-22-18-42-32(48-28(22)30)20-13-7-4-8-14-20/h3-8,11-14,21-22,25-34,37-38H,9-10,15-18H2,1-2H3/t21-,22-,25+,26+,27-,28-,29-,30-,31-,32-,33+,34+/m0/s1
InChIKey CADLZOCXOZRFQH-BLSSCCJYSA-N
Literature Reference Author H.NAMAZI,T.B.GRINDLEY
Literature Reference Citation CAN.J.CHEM.,75,983(1997)
Literature Reference DOI 10.1139/v97-118
Molecular Weight 674.699 g/mol
Solvent CDCl3
Source File Reference UWCP2481