| SpectraBase Spectrum ID |
3mGpnaoZjNh |
| Name |
3-Benzyloxy-6-bromo-5-methoxybenzylalcohol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.020457340 u |
| Formula |
C15H15BrO3 |
| InChI |
InChI=1S/C15H15BrO3/c1-18-14-8-13(7-12(9-17)15(14)16)19-10-11-5-3-2-4-6-11/h2-8,17H,9-10H2,1H3 |
| InChIKey |
LDUUMXGWTBRGTJ-UHFFFAOYSA-N |
| Molecular Weight |
323.186 g/mol |
| SMILES |
C=1(OCC2=CC=CC=C2)C=C(C(=C(C1)CO)Br)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969761 |
