| SpectraBase Compound ID | 8Kr9yCNyRyZ |
|---|---|
| InChI | InChI=1S/C9H9BrO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3 |
| InChIKey | BIHHBTVQFPVSTE-UHFFFAOYSA-N |
| Mol Weight | 229.07 g/mol |
| Molecular Formula | C9H9BrO2 |
| Exact Mass | 227.978593 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7pFINR5pWlU |
|---|---|
| Name | 2-Bromo-benzoic acid, ethyl ester |
| CAS Registry Number | 6091-64-1 |
| Comments | SHIFTCORRECTION: +0.7 PPM (A.H.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H9BrO2 |
| InChI | InChI=1S/C9H9BrO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3 |
| InChIKey | BIHHBTVQFPVSTE-UHFFFAOYSA-N |
| Instrument Name | Bruker WH-90 |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |