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1-o-p-Nitrobenzoyl-2,3,4,6-tetra-o-benzyl-.beta.-D-galactose

View entire compound with spectra: 1 NMR

1-o-p-Nitrobenzoyl-2,3,4,6-tetra-o-benzyl-.beta.-D-galactose
SpectraBase Compound ID 8ufGFruWc9i
InChI InChI=1S/C41H39NO9/c43-40(34-21-23-35(24-22-34)42(44)45)51-41-39(49-28-33-19-11-4-12-20-33)38(48-27-32-17-9-3-10-18-32)37(47-26-31-15-7-2-8-16-31)36(50-41)29-46-25-30-13-5-1-6-14-30/h1-24,36-39,41H,25-29H2/t36-,37+,38+,39-,41+/m1/s1
InChIKey IJTANGJQVDVKFH-FXWJQBGMSA-N
Mol Weight 689.8 g/mol
Molecular Formula C41H39NO9
Exact Mass 689.262482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZeHcGWKMcm
Name 1-o-p-Nitrobenzoyl-2,3,4,6-tetra-o-benzyl-.beta.-D-galactose
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 689.262481831 u
Formula C41H39NO9
InChI InChI=1S/C41H39NO9/c43-40(34-21-23-35(24-22-34)42(44)45)51-41-39(49-28-33-19-11-4-12-20-33)38(48-27-32-17-9-3-10-18-32)37(47-26-31-15-7-2-8-16-31)36(50-41)29-46-25-30-13-5-1-6-14-30/h1-24,36-39,41H,25-29H2/t36-,37+,38+,39-,41+/m1/s1
InChIKey IJTANGJQVDVKFH-FXWJQBGMSA-N
SMILES [C@]1([C@](O[C@]([C@@]([C@]1(OCC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H])(OC(C1=CC=C(C=C1)N(=O)=O)=O)[H])(COCC1=CC=CC=C1)[H])(OCC1=CC=CC=C1)[H]