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1-(2,3,4,5-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYL)-1H-BENZO-[D]-[1,2,3]-TRIAZOLE
SpectraBase Compound ID 9R6WE1RhyhW
InChI InChI=1S/C40H31N3O9/c44-37(26-15-5-1-6-16-26)48-25-32-33(50-38(45)27-17-7-2-8-18-27)34(51-39(46)28-19-9-3-10-20-28)35(52-40(47)29-21-11-4-12-22-29)36(49-32)43-31-24-14-13-23-30(31)41-42-43/h1-24,32-36H,25H2/t32-,33-,34+,35+,36+/m0/s1
InChIKey NZFSLIWYRIGLDU-JFKVGHNISA-N
Mol Weight 697.7 g/mol
Molecular Formula C40H31N3O9
Exact Mass 697.20603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GeWi5wVHrmx
Name 1-(2,3,4,5-TETRA-O-BENZOYL-ALPHA-D-MANNOPYRANOSYL)-1H-BENZO-[D]-[1,2,3]-TRIAZOLE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H31N3O9
InChI InChI=1S/C40H31N3O9/c44-37(26-15-5-1-6-16-26)48-25-32-33(50-38(45)27-17-7-2-8-18-27)34(51-39(46)28-19-9-3-10-20-28)35(52-40(47)29-21-11-4-12-22-29)36(49-32)43-31-24-14-13-23-30(31)41-42-43/h1-24,32-36H,25H2/t32-,33-,34+,35+,36+/m0/s1
InChIKey NZFSLIWYRIGLDU-JFKVGHNISA-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 697.701 g/mol
Sample ID 52749
Solvent CDCl3