| SpectraBase Compound ID | 5kNB0ZmTXCQ |
|---|---|
| InChI | InChI=1S/C10H11BrO3/c1-2-13-10(12)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3 |
| InChIKey | SXAYUOHZYFAJHK-UHFFFAOYSA-N |
| Mol Weight | 259.1 g/mol |
| Molecular Formula | C10H11BrO3 |
| Exact Mass | 257.989157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ElPa9QqymyD |
|---|---|
| Name | (2-Bromo-phenoxy)-acetic acid, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.989157211 u |
| Formula | C10H11BrO3 |
| InChI | InChI=1S/C10H11BrO3/c1-2-13-10(12)7-14-9-6-4-3-5-8(9)11/h3-6H,2,7H2,1H3 |
| InChIKey | SXAYUOHZYFAJHK-UHFFFAOYSA-N |
| Molecular Weight | 259.099 g/mol |
| SMILES | C(=O)(COC1=C(Br)C=CC=C1)OCC |