| SpectraBase Compound ID | bSriwP84rw |
|---|---|
| InChI | InChI=1S/C10H11BrO4/c1-14-8-3-6(4-10(12)13)7(11)5-9(8)15-2/h3,5H,4H2,1-2H3,(H,12,13) |
| InChIKey | MDOLAGJKKZEHHW-UHFFFAOYSA-N |
| Mol Weight | 275.1 g/mol |
| Molecular Formula | C10H11BrO4 |
| Exact Mass | 273.984072 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5D43AkttYE4 |
|---|---|
| Name | 2-Bromo-4,5-dimethoxyphenylacetic acid |
| 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/c1-14-8-3-6(4-10(12)13)7(11)5-9(8)15-2/h3,5H,4H2,1-2H3,(H,12,13) |
| InChIKey | MDOLAGJKKZEHHW-UHFFFAOYSA-N |
| SMILES | C1(=CC(=C(C=C1Br)OC)OC)CC(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.912363 |