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alpha-D-Ribofuranose 1,3,5-tribenzoate

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

alpha-D-Ribofuranose 1,3,5-tribenzoate
SpectraBase Compound ID 2i492Utf4M4
InChI InChI=1S/C26H22O8/c27-21-22(33-24(29)18-12-6-2-7-13-18)20(16-31-23(28)17-10-4-1-5-11-17)32-26(21)34-25(30)19-14-8-3-9-15-19/h1-15,20-22,26-27H,16H2/t20-,21-,22-,26-/m1/s1
InChIKey HUHVPBKTTFVAQF-PIXQIBFHSA-N
Mol Weight 462.45 g/mol
Molecular Formula C26H22O8
Exact Mass 462.131468 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FNdleXhyC5s
Name alpha-D-Ribofuranose 1,3,5-tribenzoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 462.131467660 u
Formula C26H22O8
InChI InChI=1S/C26H22O8/c27-21-22(33-24(29)18-12-6-2-7-13-18)20(16-31-23(28)17-10-4-1-5-11-17)32-26(21)34-25(30)19-14-8-3-9-15-19/h1-15,20-22,26-27H,16H2/t20-,21-,22-,26-/m1/s1
InChIKey HUHVPBKTTFVAQF-PIXQIBFHSA-N
Molecular Weight 462.454 g/mol
SMILES [C@@]1([C@@]([C@](OC(=O)C2=CC=CC=C2)([C@](O1)(COC(=O)C=1C=CC=CC1)[H])[H])(O)[H])(OC(=O)C=1C=CC=CC1)[H]
Spectrum/Structure Validation Score (Raman) 0.977464