| SpectraBase Compound ID | EyLIBLzX6FJ |
|---|---|
| InChI | InChI=1S/C9H7Br2Cl/c1-6(9(10)11)7-2-4-8(12)5-3-7/h2-5H,1H3 |
| InChIKey | PMAAKVJECIALKT-UHFFFAOYSA-N |
| Mol Weight | 310.42 g/mol |
| Molecular Formula | C9H7Br2Cl |
| Exact Mass | 307.860304 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2COnMvtfBLe |
|---|---|
| Name | 1-Chloro-4-(2,2-dibromo-1-methylvinyl)benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.860303925 u |
| Formula | C9H7Br2Cl |
| InChI | InChI=1S/C9H7Br2Cl/c1-6(9(10)11)7-2-4-8(12)5-3-7/h2-5H,1H3 |
| InChIKey | PMAAKVJECIALKT-UHFFFAOYSA-N |
| Molecular Weight | 310.416 g/mol |
| SMILES | C=1(C=CC(=CC1)C(=C(Br)Br)C)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.897013 |