| SpectraBase Compound ID | DiBeHe7M1VJ |
|---|---|
| InChI | InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7,11H,8H2,1H3 |
| InChIKey | SUSLWESCFPXNRH-UHFFFAOYSA-N |
| Mol Weight | 162.19 g/mol |
| Molecular Formula | C10H10O2 |
| Exact Mass | 162.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Cuk4FEYKiEb |
|---|---|
| Name | 3-(4-Methoxyphenyl)prop-2-yn-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.068079560 u |
| Formula | C10H10O2 |
| InChI | InChI=1S/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7,11H,8H2,1H3 |
| InChIKey | SUSLWESCFPXNRH-UHFFFAOYSA-N |
| Molecular Weight | 162.188 g/mol |
| SMILES | C=1C=C(C#CCO)C=CC1OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938643 |