| SpectraBase Compound ID | 6JWxBkfAl17 |
|---|---|
| InChI | InChI=1S/C14H11BrO3/c1-17-10-6-8-11(9-7-10)18-14(16)12-4-2-3-5-13(12)15/h2-9H,1H3 |
| InChIKey | QQNKHSHHKAMKKT-UHFFFAOYSA-N |
| Mol Weight | 307.14 g/mol |
| Molecular Formula | C14H11BrO3 |
| Exact Mass | 305.989157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7lREeDHiXH0 |
|---|---|
| Name | 2-Bromobenzoic acid, 4-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.989157211 u |
| Formula | C14H11BrO3 |
| InChI | InChI=1S/C14H11BrO3/c1-17-10-6-8-11(9-7-10)18-14(16)12-4-2-3-5-13(12)15/h2-9H,1H3 |
| InChIKey | QQNKHSHHKAMKKT-UHFFFAOYSA-N |
| Molecular Weight | 307.143 g/mol |
| SMILES | C1=CC=C(C(=C1)C(OC1=CC=C(OC)C=C1)=O)Br |