![3-Methylspiro[4.5]dec-3-ene-2,8-dione](/api/spectrum/EwvPd84IRR3/structure.png?h=300&w=458 "3-Methylspiro[4.5]dec-3-ene-2,8-dione")
| SpectraBase Compound ID | 1vmRBsMfXwS |
|---|---|
| InChI | InChI=1S/C11H14O2/c1-8-6-11(7-10(8)13)4-2-9(12)3-5-11/h6H,2-5,7H2,1H3 |
| InChIKey | QFJCFBOZZSHREK-UHFFFAOYSA-N |
| Mol Weight | 178.23 g/mol |
| Molecular Formula | C11H14O2 |
| Exact Mass | 178.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EwvPd84IRR3 |
|---|---|
| Name | 3-Methylspiro[4.5]dec-3-ene-2,8-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.099379689 u |
| Formula | C11H14O2 |
| InChI | InChI=1S/C11H14O2/c1-8-6-11(7-10(8)13)4-2-9(12)3-5-11/h6H,2-5,7H2,1H3 |
| InChIKey | QFJCFBOZZSHREK-UHFFFAOYSA-N |
| Molecular Weight | 178.231 g/mol |
| SMILES | C1C(C(=CC11CCC(CC1)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977988 |