| SpectraBase Compound ID | CLsuxiugjwq |
|---|---|
| InChI | InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-17(19)15-14-16(2)18/h3-15H2,1-2H3 |
| InChIKey | LLTHTKFMTCJTHY-UHFFFAOYSA-N |
| Mol Weight | 268.4 g/mol |
| Molecular Formula | C17H32O2 |
| Exact Mass | 268.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | G8L5VPr2Af5 |
|---|---|
| Name | 2,5-Heptadecadione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.240230268 u |
| Formula | C17H32O2 |
| InChI | InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-17(19)15-14-16(2)18/h3-15H2,1-2H3 |
| InChIKey | LLTHTKFMTCJTHY-UHFFFAOYSA-N |
| SMILES | CC(CCC(CCCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.848558 |