| SpectraBase Spectrum ID |
3XfxnyZZFA |
| Name |
2-Bromobenzoic acid methyl ester |
| CAS Registry Number |
165111-46-6 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
213.962942463 u |
| Formula |
C8H7BrO2 |
| InChI |
InChI=1S/C8H7BrO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3 |
| InChIKey |
SWGQITQOBPXVRC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
215.046 g/mol |
| Nominal Mass |
214 u |
| Quality |
998 |
| Retention Index |
1377 |
| SMILES |
C1(=C(C=CC=C1)Br)C(OC)=O |
| SPLASH |
splash10-0540-2930000000-72da3ce6c71555094555 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl 2-bromo benzoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024389 |
