| SpectraBase Compound ID | 9KIu5qCphNm |
|---|---|
| InChI | InChI=1S/C10H8O2/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6,11H,8H2 |
| InChIKey | NWLZAQXAJNDAIK-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C10H8O2 |
| Exact Mass | 160.052429 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Bwzz65CfGU1 |
|---|---|
| Name | 4-Hydroxy-1-phenyl-2-butyn-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.052429496 u |
| Formula | C10H8O2 |
| InChI | InChI=1S/C10H8O2/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6,11H,8H2 |
| InChIKey | NWLZAQXAJNDAIK-UHFFFAOYSA-N |
| Molecular Weight | 160.172 g/mol |
| SMILES | C(#CCO)C(=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963015 |