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.beta.,D-Xylopyranose Tetrabenzoate

View entire compound with spectra: 1 MS (GC)

.beta.,D-Xylopyranose Tetrabenzoate
SpectraBase Compound ID 7DhXqwAh6EZ
InChI InChI=1S/C33H26O9/c34-29(22-13-5-1-6-14-22)39-26-21-38-33(42-32(37)25-19-11-4-12-20-25)28(41-31(36)24-17-9-3-10-18-24)27(26)40-30(35)23-15-7-2-8-16-23/h1-20,26-28,33H,21H2/t26-,27+,28-,33+/m1/s1
InChIKey YHLULIUXPPJCPL-CPWWYQHDSA-N
Mol Weight 566.6 g/mol
Molecular Formula C33H26O9
Exact Mass 566.157682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AriWtYQJQKb
Name .beta.,D-Xylopyranose Tetrabenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H26O9
InChI InChI=1S/C33H26O9/c34-29(22-13-5-1-6-14-22)39-26-21-38-33(42-32(37)25-19-11-4-12-20-25)28(41-31(36)24-17-9-3-10-18-24)27(26)40-30(35)23-15-7-2-8-16-23/h1-20,26-28,33H,21H2/t26-,27+,28-,33+/m1/s1
InChIKey YHLULIUXPPJCPL-CPWWYQHDSA-N
Molecular Weight 566.562 g/mol
SMILES [C@@]1([C@@](OC(=O)c2ccccc2)([C@](OC(=O)c2ccccc2)(CO[C@]1(OC(=O)c1ccccc1)[H])[H])[H])(OC(=O)c1ccccc1)[H]
SPLASH splash10-0a6r-5900000000-58b6b50a5f64280b7548
Source of Spectrum C-114-1397-12
Wiley ID 1408052