| SpectraBase Compound ID | FB5j8hggJst |
|---|---|
| InChI | InChI=1S/C5H8Br2/c1-4(2)5(7)3-6/h5H,1,3H2,2H3 |
| InChIKey | IXEIUHHZCBHHOV-UHFFFAOYSA-N |
| Mol Weight | 227.93 g/mol |
| Molecular Formula | C5H8Br2 |
| Exact Mass | 225.899276 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8UXWGj697Nh |
|---|---|
| Name | 1-Butene, 3,4-dibromo-2-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.899276258 u |
| Formula | C5H8Br2 |
| InChI | InChI=1S/C5H8Br2/c1-4(2)5(7)3-6/h5H,1,3H2,2H3 |
| InChIKey | IXEIUHHZCBHHOV-UHFFFAOYSA-N |
| Molecular Weight | 227.927 g/mol |
| SMILES | C(=C)(C(Br)CBr)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907463 |