| SpectraBase Compound ID | 4fzu7dsPaNO |
|---|---|
| InChI | InChI=1S/C11H14O2/c1-9(7-8-12)11(13)10-5-3-2-4-6-10/h2-7,11-13H,8H2,1H3/b9-7+ |
| InChIKey | YNVGLWAUJULWAF-VQHVLOKHSA-N |
| Mol Weight | 178.23 g/mol |
| Molecular Formula | C11H14O2 |
| Exact Mass | 178.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | K7AkeH5o6be |
|---|---|
| Name | (E)-2-Methyl-1-phenylbut-2-ene-1,4-diol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.099379689 u |
| Formula | C11H14O2 |
| InChI | InChI=1S/C11H14O2/c1-9(7-8-12)11(13)10-5-3-2-4-6-10/h2-7,11-13H,8H2,1H3/b9-7+ |
| InChIKey | YNVGLWAUJULWAF-VQHVLOKHSA-N |
| Molecular Weight | 178.231 g/mol |
| SMILES | C(\C(=C\CO)C)(C1=CC=CC=C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.855632 |