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2,3,4,6-Tetra-o-benzyl-alpha-D-mannopyranosyl(pivaloyl)phosphite

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2,3,4,6-Tetra-o-benzyl-alpha-D-mannopyranosyl(pivaloyl)phosphite
SpectraBase Compound ID 6XpGkU1Tdnd
InChI InChI=1S/C39H45O9P/c1-39(2,3)38(40)48-49(41)47-37-36(45-27-32-22-14-7-15-23-32)35(44-26-31-20-12-6-13-21-31)34(43-25-30-18-10-5-11-19-30)33(46-37)28-42-24-29-16-8-4-9-17-29/h4-23,33-37,49H,24-28H2,1-3H3/t33-,34-,35+,36+,37-/m1/s1
InChIKey MLTIEWBJTNUHIY-GDWCTEMXSA-N
Mol Weight 688.8 g/mol
Molecular Formula C39H45O9P
Exact Mass 688.28012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7jKeL9zFfQ0
Name 2,3,4,6-Tetra-o-benzyl-alpha-D-mannopyranosyl(pivaloyl)phosphite
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 688.280120018 u
Formula C39H45O9P
InChI InChI=1S/C39H45O9P/c1-39(2,3)38(40)48-49(41)47-37-36(45-27-32-22-14-7-15-23-32)35(44-26-31-20-12-6-13-21-31)34(43-25-30-18-10-5-11-19-30)33(46-37)28-42-24-29-16-8-4-9-17-29/h4-23,33-37,49H,24-28H2,1-3H3/t33-,34-,35+,36+,37-/m1/s1
InChIKey MLTIEWBJTNUHIY-GDWCTEMXSA-N
Molecular Weight 688.754 g/mol
SMILES C(OP(=O)O[C@@]1([C@]([C@]([C@@]([C@](O1)(COCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H])[H])(=O)C(C)(C)C