| SpectraBase Compound ID | KQGw0Dui2Wy |
|---|---|
| InChI | InChI=1S/C13H9BrO2/c14-11-7-4-8-12(9-11)16-13(15)10-5-2-1-3-6-10/h1-9H |
| InChIKey | ALYKUDRBSKNACP-UHFFFAOYSA-N |
| Mol Weight | 277.12 g/mol |
| Molecular Formula | C13H9BrO2 |
| Exact Mass | 275.978593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A7WSQSRnN21 |
|---|---|
| Name | (3-bromophenyl) benzoate |
| Alternate Name(s) | benzoic acid (3-bromophenyl) ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9BrO2 |
| InChI | InChI=1S/C13H9BrO2/c14-11-7-4-8-12(9-11)16-13(15)10-5-2-1-3-6-10/h1-9H |
| InChIKey | ALYKUDRBSKNACP-UHFFFAOYSA-N |
| Molecular Weight | 277.117 g/mol |
| SMILES | C(Oc1cc(Br)ccc1)(=O)c1ccccc1 |
| SPLASH | splash10-0a6r-5900000000-560dd6f5bc14e99370bb |
| Source of Spectrum | QB-21-54-2 |
| Wiley ID | 860524 |