| SpectraBase Compound ID | 6tjfoO1Qxbz |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-11(6-5-9-13)14-10-12-7-3-2-4-8-12/h2-4,7-8,11,13H,9-10H2,1H3 |
| InChIKey | OJZFNZKAHJCCNL-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6lLsqQavdZP |
|---|---|
| Name | 4-(Phenylmethoxy)pent-2-yn-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-11(6-5-9-13)14-10-12-7-3-2-4-8-12/h2-4,7-8,11,13H,9-10H2,1H3 |
| InChIKey | OJZFNZKAHJCCNL-UHFFFAOYSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(C#CC(C)OCC=1C=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.803322 |