| SpectraBase Compound ID | 1DhLsOMODa7 |
|---|---|
| InChI | InChI=1S/C7H13I/c1-2-3-4-5-6-7-8/h6-7H,2-5H2,1H3/b7-6- |
| InChIKey | XULQQNDHGTXWAD-SREVYHEPSA-N |
| Mol Weight | 224.09 g/mol |
| Molecular Formula | C7H13I |
| Exact Mass | 224.006195 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6i9mhyT9YGh |
|---|---|
| Name | (Z)-1-Iodo-1-heptene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.006195419 u |
| Formula | C7H13I |
| InChI | InChI=1S/C7H13I/c1-2-3-4-5-6-7-8/h6-7H,2-5H2,1H3/b7-6- |
| InChIKey | XULQQNDHGTXWAD-SREVYHEPSA-N |
| Molecular Weight | 224.085 g/mol |
| SMILES | C(\C=C/I)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973581 |