| SpectraBase Compound ID | 8Kw9qCxMhpr |
|---|---|
| InChI | InChI=1S/C6H10Br2O2/c1-3-10-6(9)5(8)4(2)7/h4-5H,3H2,1-2H3 |
| InChIKey | YPZLAXFGOUPECS-UHFFFAOYSA-N |
| Mol Weight | 273.95 g/mol |
| Molecular Formula | C6H10Br2O2 |
| Exact Mass | 271.904756 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EICs1UvlIgl |
|---|---|
| Name | 2,3-Dibromobutyric acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.904755560 u |
| Formula | C6H10Br2O2 |
| InChI | InChI=1S/C6H10Br2O2/c1-3-10-6(9)5(8)4(2)7/h4-5H,3H2,1-2H3 |
| InChIKey | YPZLAXFGOUPECS-UHFFFAOYSA-N |
| SMILES | C(OCC)(C(C(C)Br)Br)=O |
| Spectrum/Structure Validation Score (Raman) | 0.90733 |