| SpectraBase Compound ID | Hf3Bm2S16vZ |
|---|---|
| InChI | InChI=1S/C7H10BrClO2/c8-4-1-3-7(10)11-6-2-5-9/h2,5H,1,3-4,6H2/b5-2+ |
| InChIKey | MXEQMDIIUFQSMS-GORDUTHDSA-N |
| Mol Weight | 241.51 g/mol |
| Molecular Formula | C7H10BrClO2 |
| Exact Mass | 239.95527 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5LZjziJl4u3 |
|---|---|
| Name | 4-Bromobutanoic acid, 3-chloroprop-2-enyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.955270260 u |
| Formula | C7H10BrClO2 |
| InChI | InChI=1S/C7H10BrClO2/c8-4-1-3-7(10)11-6-2-5-9/h2,5H,1,3-4,6H2/b5-2+ |
| InChIKey | MXEQMDIIUFQSMS-GORDUTHDSA-N |
| Molecular Weight | 241.512 g/mol |
| SMILES | C(CCC(=O)OC\C=C\Cl)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.989308 |