| SpectraBase Compound ID | DFQVe8GAfNd |
|---|---|
| InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3 |
| InChIKey | KMFJVYMFCAIRAN-UHFFFAOYSA-N |
| Mol Weight | 215.05 g/mol |
| Molecular Formula | C8H7BrO2 |
| Exact Mass | 213.962942 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | HTdXL0GEdgo |
|---|---|
| Name | Methyl 3-bromobenzoate |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 499625 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7BrO2 |
| InChI | InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3 |
| InChIKey | KMFJVYMFCAIRAN-UHFFFAOYSA-N |
| Molecular Weight | 215.046 g/mol |
| Observed nucleus | 13C |
| Purity | 98% |
| Solvent | CDCl3 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_014934 |