![Spiro[5.5]undecane-1,7-dione](/api/spectrum/DovClI72cvL/structure.png?h=300&w=458 "Spiro[5.5]undecane-1,7-dione")
| SpectraBase Compound ID | EaJ3YIVHZg0 |
|---|---|
| InChI | InChI=1S/C11H16O2/c12-9-5-1-3-7-11(9)8-4-2-6-10(11)13/h1-8H2 |
| InChIKey | MZJOHIUPSBPBDB-UHFFFAOYSA-N |
| Mol Weight | 180.25 g/mol |
| Molecular Formula | C11H16O2 |
| Exact Mass | 180.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DovClI72cvL |
|---|---|
| Name | Spiro[5.5]undecane-1,7-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.115029753 u |
| Formula | C11H16O2 |
| InChI | InChI=1S/C11H16O2/c12-9-5-1-3-7-11(9)8-4-2-6-10(11)13/h1-8H2 |
| InChIKey | MZJOHIUPSBPBDB-UHFFFAOYSA-N |
| Molecular Weight | 180.247 g/mol |
| SMILES | C1(=O)CCCCC11C(CCCC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.886231 |