| SpectraBase Compound ID | LNrWwEq3jwt |
|---|---|
| InChI | InChI=1S/C5H8ClI/c6-4-2-1-3-5-7/h3,5H,1-2,4H2/b5-3+ |
| InChIKey | FVUMKCANAVCHLS-HWKANZROSA-N |
| Mol Weight | 230.48 g/mol |
| Molecular Formula | C5H8ClI |
| Exact Mass | 229.935923 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CkDMPRD25XY |
|---|---|
| Name | 5-Chloro-1-iodo-1-pentene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.935922958 u |
| Formula | C5H8ClI |
| InChI | InChI=1S/C5H8ClI/c6-4-2-1-3-5-7/h3,5H,1-2,4H2/b5-3+ |
| InChIKey | FVUMKCANAVCHLS-HWKANZROSA-N |
| Molecular Weight | 230.476 g/mol |
| SMILES | C(\C=C\I)CCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937194 |