For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Tribenzyl N-acetyl-N,1-dibenzoylgalactosamine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Tribenzyl N-acetyl-N,1-dibenzoylgalactosamine
SpectraBase Compound ID 7EYHXbnDyuN
InChI InChI=1S/C43H41NO8/c1-31(45)44(41(46)35-23-13-5-14-24-35)38-40(50-29-34-21-11-4-12-22-34)39(49-28-33-19-9-3-10-20-33)37(30-48-27-32-17-7-2-8-18-32)51-43(38)52-42(47)36-25-15-6-16-26-36/h2-26,37-40,43H,27-30H2,1H3
InChIKey IESOLHPEAVTOKJ-UHFFFAOYSA-N
Mol Weight 699.8 g/mol
Molecular Formula C43H41NO8
Exact Mass 699.283217 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8mDepp70WGu
Name Tribenzyl N-acetyl-N,1-dibenzoylgalactosamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 699.283217276 u
Formula C43H41NO8
InChI InChI=1S/C43H41NO8/c1-31(45)44(41(46)35-23-13-5-14-24-35)38-40(50-29-34-21-11-4-12-22-34)39(49-28-33-19-9-3-10-20-33)37(30-48-27-32-17-7-2-8-18-32)51-43(38)52-42(47)36-25-15-6-16-26-36/h2-26,37-40,43H,27-30H2,1H3
InChIKey IESOLHPEAVTOKJ-UHFFFAOYSA-N
SMILES C1(C(C(OC(C1N(C(=O)C=1C=CC=CC1)C(=O)C)OC(=O)C1=CC=CC=C1)COCC1=CC=CC=C1)OCC1=CC=CC=C1)OCC=1C=CC=CC1