| SpectraBase Spectrum ID |
ANcks96HRrp |
| Name |
2-Bromo-1,5,8-trimethoxynaphthalene-3-methanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.015371959 u |
| Formula |
C14H15BrO4 |
| InChI |
InChI=1S/C14H15BrO4/c1-17-10-4-5-11(18-2)12-9(10)6-8(7-16)13(15)14(12)19-3/h4-6,16H,7H2,1-3H3 |
| InChIKey |
OYIDDHIGROYECJ-UHFFFAOYSA-N |
| Molecular Weight |
327.174 g/mol |
| SMILES |
C12=C(C(Br)=C(C=C2C(OC)=CC=C1OC)CO)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924952 |
