| SpectraBase Compound ID | H2LtIBIFnAF |
|---|---|
| InChI | InChI=1S/C17H30O2/c1-3-5-7-9-11-13-17(19)15-14-16(18)12-10-8-6-4-2/h4H,2-3,5-15H2,1H3 |
| InChIKey | RXNAHKUSLPBDQW-UHFFFAOYSA-N |
| Mol Weight | 266.42 g/mol |
| Molecular Formula | C17H30O2 |
| Exact Mass | 266.22458 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | V78b00KFDo |
|---|---|
| Name | 1-Heptadecen-7,10-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.224580204 u |
| Formula | C17H30O2 |
| InChI | InChI=1S/C17H30O2/c1-3-5-7-9-11-13-17(19)15-14-16(18)12-10-8-6-4-2/h4H,2-3,5-15H2,1H3 |
| InChIKey | RXNAHKUSLPBDQW-UHFFFAOYSA-N |
| Molecular Weight | 266.425 g/mol |
| SMILES | C(CC(CCC(CCCCCCC)=O)=O)CCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87949 |