| SpectraBase Compound ID | IOs3zEf4e2D |
|---|---|
| InChI | InChI=1S/C8H7BrO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5H2,(H,10,11) |
| InChIKey | FTPAHNNMUYOHOB-UHFFFAOYSA-N |
| Mol Weight | 215.05 g/mol |
| Molecular Formula | C8H7BrO2 |
| Exact Mass | 213.962942 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FUVwpyIgTU2 |
|---|---|
| Name | 3-Bromomethylbenzoic acid |
| CAS Registry Number | 6515-58-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7BrO2 |
| InChI | InChI=1S/C8H7BrO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5H2,(H,10,11) |
| InChIKey | FTPAHNNMUYOHOB-UHFFFAOYSA-N |
| Molecular Weight | 215.046 g/mol |
| SMILES | OC(c1cc(CBr)ccc1)=O |
| SPLASH | splash10-000i-4910000000-a4957fcc51180fc9390a |
| Wiley ID | 1477128 |