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1-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-MANNOPYRANOSYL)-4-PHENYL-1H-1,2,3-TRIAZOLE
SpectraBase Compound ID 58N46ddtoJ1
InChI InChI=1S/C42H33N3O9/c46-39(29-18-8-2-9-19-29)50-27-34-35(52-40(47)30-20-10-3-11-21-30)36(53-41(48)31-22-12-4-13-23-31)37(54-42(49)32-24-14-5-15-25-32)38(51-34)45-26-33(43-44-45)28-16-6-1-7-17-28/h1-26,34-38H,27H2/t34-,35-,36+,37+,38-/m0/s1
InChIKey GFARAJLQFZSUTF-HBTODDBMSA-N
Mol Weight 723.7 g/mol
Molecular Formula C42H33N3O9
Exact Mass 723.22168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0UXq1fTY32
Name 1-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-MANNOPYRANOSYL)-4-PHENYL-1H-1,2,3-TRIAZOLE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H33N3O9
InChI InChI=1S/C42H33N3O9/c46-39(29-18-8-2-9-19-29)50-27-34-35(52-40(47)30-20-10-3-11-21-30)36(53-41(48)31-22-12-4-13-23-31)37(54-42(49)32-24-14-5-15-25-32)38(51-34)45-26-33(43-44-45)28-16-6-1-7-17-28/h1-26,34-38H,27H2/t34-,35-,36+,37+,38-/m0/s1
InChIKey GFARAJLQFZSUTF-HBTODDBMSA-N
Literature Reference Author J.A.WATT,C.T.GANNON,K.J.LOFT,Z.DINEV,S.J.WILLIAMS
Literature Reference Citation AUSTR.J.CHEM.,61,837(2008)
Literature Reference DOI 10.1071/ch08364
Molecular Weight 723.739 g/mol
Sample ID 52761
Solvent CDCl3