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PHENYL-2,3,4-TRI-O-BENZOYL-1-THIO-6-O-BIS-(2,2,2-TRICHLOROETHOXY)-PHOSPHORYL-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID BJBCiBwazFL
InChI InChI=1S/C37H31Cl6O11PS/c38-36(39,40)22-49-55(47,50-23-37(41,42)43)48-21-28-29(52-32(44)24-13-5-1-6-14-24)30(53-33(45)25-15-7-2-8-16-25)31(54-34(46)26-17-9-3-10-18-26)35(51-28)56-27-19-11-4-12-20-27/h1-20,28-31,35H,21-23H2/t28-,29-,30+,31+,35-/m1/s1
InChIKey DDIGOUKDCGFZDM-GSQBBPPKSA-N
Mol Weight 927.4 g/mol
Molecular Formula C37H31Cl6O11PS
Exact Mass 923.945586 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VAWnSv2irp
Name PHENYL-2,3,4-TRI-O-BENZOYL-1-THIO-6-O-BIS-(2,2,2-TRICHLOROETHOXY)-PHOSPHORYL-ALPHA-D-MANNOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H31Cl6O11PS
InChI InChI=1S/C37H31Cl6O11PS/c38-36(39,40)22-49-55(47,50-23-37(41,42)43)48-21-28-29(52-32(44)24-13-5-1-6-14-24)30(53-33(45)25-15-7-2-8-16-25)31(54-34(46)26-17-9-3-10-18-26)35(51-28)56-27-19-11-4-12-20-27/h1-20,28-31,35H,21-23H2/t28-,29-,30+,31+,35-/m1/s1
InChIKey DDIGOUKDCGFZDM-GSQBBPPKSA-N
Literature Reference Author M.K.CHRISTENSEN,M.MELDAL,K.BOCK
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1453(1993)
Literature Reference DOI 10.1039/p19930001453
Molecular Weight 927.398 g/mol
Solvent CDCl3
Source File Reference UWCP6262