| SpectraBase Compound ID | KKphlF6YdqZ |
|---|---|
| InChI | InChI=1S/C7H14O/c1-6(2)4-7(3)5-8/h4,6,8H,5H2,1-3H3/b7-4+ |
| InChIKey | FRNHNENZDWMNBU-QPJJXVBHSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1oyyidmbF3o |
|---|---|
| Name | 2,4-Dimethylpent-2-en-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.104465070 u |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-6(2)4-7(3)5-8/h4,6,8H,5H2,1-3H3/b7-4+ |
| InChIKey | FRNHNENZDWMNBU-QPJJXVBHSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C(\C(=C\C(C)C)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96151 |