| SpectraBase Compound ID | EoqqEuGxAEF |
|---|---|
| InChI | InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | HUEBIMLTDXKIPR-UHFFFAOYSA-N |
| Mol Weight | 284.5 g/mol |
| Molecular Formula | C18H36O2 |
| Exact Mass | 284.27153 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7JJlKFWy3Jr |
|---|---|
| Name | Heptadecanoic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.271530397 u |
| Formula | C18H36O2 |
| InChI | InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | HUEBIMLTDXKIPR-UHFFFAOYSA-N |
| SMILES | CCCCCCCCCCCCCCCCC(OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.989503 |