| SpectraBase Compound ID | wCuAr3iGzi |
|---|---|
| InChI | InChI=1S/C7H11IO/c1-5(2)7(8)4-6(3)9/h4,6,9H,1H2,2-3H3/b7-4- |
| InChIKey | MMSVCBFGOXAYGQ-DAXSKMNVSA-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 | M5xr5xi16H |
|---|---|
| Name | 4-Iodo-5-methylhexa-3,5-dien-2-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/c1-5(2)7(8)4-6(3)9/h4,6,9H,1H2,2-3H3/b7-4- |
| InChIKey | MMSVCBFGOXAYGQ-DAXSKMNVSA-N |
| Molecular Weight | 238.068 g/mol |
| SMILES | C(\C=C\(C(=C)C)I)(O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.908691 |