| SpectraBase Compound ID | 2da55olkJU3 |
|---|---|
| InChI | InChI=1S/C7H10Br2O2/c1-2-3-6(5(10)11)4-7(6,8)9/h2-4H2,1H3,(H,10,11) |
| InChIKey | KIJVCDMJGURPFU-UHFFFAOYSA-N |
| Mol Weight | 285.96 g/mol |
| Molecular Formula | C7H10Br2O2 |
| Exact Mass | 283.904756 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JFPQlOLgAkA |
|---|---|
| Name | (2,2-Dibromo-1-propylcyclopropane)carboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.904755560 u |
| Formula | C7H10Br2O2 |
| InChI | InChI=1S/C7H10Br2O2/c1-2-3-6(5(10)11)4-7(6,8)9/h2-4H2,1H3,(H,10,11) |
| InChIKey | KIJVCDMJGURPFU-UHFFFAOYSA-N |
| SMILES | C1(C(Br)(Br)C1)(C(=O)O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.809097 |