| SpectraBase Compound ID | EWUHpeivnPZ |
|---|---|
| InChI | InChI=1S/C8H12O2/c1-6(9)7-3-2-4-8(10)5-7/h5,8,10H,2-4H2,1H3 |
| InChIKey | ITPPAWADXHMHMF-UHFFFAOYSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KtzvdQb4N2f |
|---|---|
| Name | 1-(3-Hydroxy-1-cyclohexen-1-yl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 140.083729624 u |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c1-6(9)7-3-2-4-8(10)5-7/h5,8,10H,2-4H2,1H3 |
| InChIKey | ITPPAWADXHMHMF-UHFFFAOYSA-N |
| SMILES | C(C)(C1=CC(CCC1)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.932513 |