| SpectraBase Compound ID | HpCDIBgWGbk |
|---|---|
| InChI | InChI=1S/C8H13I/c9-7-3-6-8-4-1-2-5-8/h4H,1-3,5-7H2 |
| InChIKey | DZCUMHURRKMPNB-UHFFFAOYSA-N |
| Mol Weight | 236.1 g/mol |
| Molecular Formula | C8H13I |
| Exact Mass | 236.006195 g/mol |
| SpectraBase Spectrum ID | HZFt9YGUrsZ |
|---|---|
| Name | 1-(3-Iodopropyl)cyclopentene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.006195419 u |
| Formula | C8H13I |
| InChI | InChI=1S/C8H13I/c9-7-3-6-8-4-1-2-5-8/h4H,1-3,5-7H2 |
| InChIKey | DZCUMHURRKMPNB-UHFFFAOYSA-N |
| Molecular Weight | 236.096 g/mol |
| SMILES | C1(=CCCC1)CCCI |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926743 |