| SpectraBase Compound ID | ExlJ5LhVcK2 |
|---|---|
| InChI | InChI=1S/C7H11IO/c1-2-3-4-5-7(8)6-9/h2,5,9H,1,3-4,6H2/b7-5- |
| InChIKey | GSWWLADUEIQBBQ-ALCCZGGFSA-N |
| Mol Weight | 238.07 g/mol |
| Molecular Formula | C7H11IO |
| Exact Mass | 237.98546 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6M9W5vRcS9i |
|---|---|
| Name | (2Z)-2-Iodohepta-2,6-dien-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.985459973 u |
| Formula | C7H11IO |
| InChI | InChI=1S/C7H11IO/c1-2-3-4-5-7(8)6-9/h2,5,9H,1,3-4,6H2/b7-5- |
| InChIKey | GSWWLADUEIQBBQ-ALCCZGGFSA-N |
| Molecular Weight | 238.068 g/mol |
| SMILES | C(\C=C\(I)CO)CC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.829986 |