SpectraBase Spectrum ID |
AMUIYtNa7GE |
Name |
m-Bromophenyl beta-D-xylopyranoside |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.994636514 u |
Formula |
C11H13BrO5 |
InChI |
InChI=1S/C11H13BrO5/c12-6-2-1-3-7(4-6)17-11-10(15)9(14)8(13)5-16-11/h1-4,8-11,13-15H,5H2/t8-,9+,10-,11?/m0/s1 |
InChIKey |
LHJCABHRLLAVSP-JDUUOCRZSA-N |
Molecular Weight |
305.124 g/mol |
SMILES |
O[C@]1(COC([C@]([C@@]1(O)[H])(O)[H])OC1=CC=CC(=C1)Br)[H] |
Spectrum/Structure Validation Score (Raman) |
0.79318 |