| SpectraBase Compound ID | 3VAfhXFXIpU |
|---|---|
| InChI | InChI=1S/C16H30O2/c1-15(17)13-11-9-7-5-3-4-6-8-10-12-14-16(2)18/h3-14H2,1-2H3 |
| InChIKey | ANOHLAYDIMKILU-UHFFFAOYSA-N |
| Mol Weight | 254.41 g/mol |
| Molecular Formula | C16H30O2 |
| Exact Mass | 254.22458 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1yqOxB81PmM |
|---|---|
| Name | 2,15-Hexadecanedione; hexadecane-2,15-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.224580204 u |
| Formula | C16H30O2 |
| InChI | InChI=1S/C16H30O2/c1-15(17)13-11-9-7-5-3-4-6-8-10-12-14-16(2)18/h3-14H2,1-2H3 |
| InChIKey | ANOHLAYDIMKILU-UHFFFAOYSA-N |
| Molecular Weight | 254.414 g/mol |
| SMILES | CC(CCCCCCCCCCCCC(C)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.887445 |