| SpectraBase Compound ID | HLqZWvcbs82 |
|---|---|
| InChI | InChI=1S/C10H16O3/c11-9-5-1-2-7-10(12)13-8-4-3-6-9/h1-8H2 |
| InChIKey | KITKBQHYNLJQSF-UHFFFAOYSA-N |
| Mol Weight | 184.23 g/mol |
| Molecular Formula | C10H16O3 |
| Exact Mass | 184.109944 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IfeJlfze9e7 |
|---|---|
| Name | Oxacycloundecane-2,7-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.109944372 u |
| Formula | C10H16O3 |
| InChI | InChI=1S/C10H16O3/c11-9-5-1-2-7-10(12)13-8-4-3-6-9/h1-8H2 |
| InChIKey | KITKBQHYNLJQSF-UHFFFAOYSA-N |
| Molecular Weight | 184.235 g/mol |
| SMILES | C1(=O)CCCCC(CCCCO1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986863 |