| SpectraBase Compound ID | I4Ioh8Eu2qp |
|---|---|
| InChI | InChI=1S/C4H6ClI/c1-2-4(5)3-6/h2,4H,1,3H2 |
| InChIKey | PAXYDKDMFDNEBX-UHFFFAOYSA-N |
| Mol Weight | 216.45 g/mol |
| Molecular Formula | C4H6ClI |
| Exact Mass | 215.920273 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LWpL2i12g7 |
|---|---|
| Name | 3-Chloro-4-iodobut-1-ene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.920272893 u |
| Formula | C4H6ClI |
| InChI | InChI=1S/C4H6ClI/c1-2-4(5)3-6/h2,4H,1,3H2 |
| InChIKey | PAXYDKDMFDNEBX-UHFFFAOYSA-N |
| Molecular Weight | 216.449 g/mol |
| SMILES | C=CC(CI)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93169 |