| SpectraBase Compound ID | A5lb1XqT26q |
|---|---|
| InChI | InChI=1S/C10H14O2/c1-7(2)6-10(3)8(11)4-5-9(10)12/h1,4-6H2,2-3H3 |
| InChIKey | SJEGWSUNTITUPW-UHFFFAOYSA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C10H14O2 |
| Exact Mass | 166.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1OOWFZK31bs |
|---|---|
| Name | 2-Methyl-2-(2-methylallyl)cyclopentane-1,3-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.099379689 u |
| Formula | C10H14O2 |
| InChI | InChI=1S/C10H14O2/c1-7(2)6-10(3)8(11)4-5-9(10)12/h1,4-6H2,2-3H3 |
| InChIKey | SJEGWSUNTITUPW-UHFFFAOYSA-N |
| Molecular Weight | 166.220 g/mol |
| SMILES | C1(C(CCC1=O)=O)(CC(=C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.82476 |