SpectraBase Spectrum ID |
9viYCxsnrhF |
Name |
4-Bromo-2-methoxyphenol, o-ethoxycarbonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
273.984071830 u |
Formula |
C10H11BrO4 |
InChI |
InChI=1S/C10H11BrO4/c1-3-14-10(12)15-8-5-4-7(11)6-9(8)13-2/h4-6H,3H2,1-2H3 |
InChIKey |
PYLAITBWXLKDEB-UHFFFAOYSA-N |
Molecular Weight |
275.098 g/mol |
SMILES |
C1(=CC(=CC=C1OC(OCC)=O)Br)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95314 |