| SpectraBase Compound ID | I7AIHtCezJA |
|---|---|
| InChI | InChI=1S/C7H10O/c1-5-3-4-6(2)7(5)8/h3,6H,4H2,1-2H3 |
| InChIKey | GBTHLOLSKPVPOD-UHFFFAOYSA-N |
| Mol Weight | 110.16 g/mol |
| Molecular Formula | C7H10O |
| Exact Mass | 110.073165 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EWgIkny4kyA |
|---|---|
| Name | 2,5-Dimethyl-2-cyclopentenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 110.073164941 u |
| Formula | C7H10O |
| InChI | InChI=1S/C7H10O/c1-5-3-4-6(2)7(5)8/h3,6H,4H2,1-2H3 |
| InChIKey | GBTHLOLSKPVPOD-UHFFFAOYSA-N |
| Molecular Weight | 110.156 g/mol |
| SMILES | C1(C(=CCC1C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.817498 |