| SpectraBase Compound ID | A9WG65wiaSq |
|---|---|
| InChI | InChI=1S/C15H28O2/c1-3-5-7-9-11-15(17)13-12-14(16)10-8-6-4-2/h3-13H2,1-2H3 |
| InChIKey | DAMXWJVXXVXGNB-UHFFFAOYSA-N |
| Mol Weight | 240.39 g/mol |
| Molecular Formula | C15H28O2 |
| Exact Mass | 240.20893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GT7Z9X03TtV |
|---|---|
| Name | 6,9-Pentadecadione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.208930140 u |
| Formula | C15H28O2 |
| InChI | InChI=1S/C15H28O2/c1-3-5-7-9-11-15(17)13-12-14(16)10-8-6-4-2/h3-13H2,1-2H3 |
| InChIKey | DAMXWJVXXVXGNB-UHFFFAOYSA-N |
| Molecular Weight | 240.387 g/mol |
| SMILES | C(CC(CCC(CCCCCC)=O)=O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961158 |