| SpectraBase Compound ID | 6FiknQMySfg |
|---|---|
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-21-17-15-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | MEAJTVDNJOGGJW-UHFFFAOYSA-N |
| Mol Weight | 300.5 g/mol |
| Molecular Formula | C18H36O3 |
| Exact Mass | 300.266445 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | GQL3xFIC8dX |
|---|---|
| Name | 3-(Tetradecyloxy)propionic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.266445016 u |
| Formula | C18H36O3 |
| InChI | InChI=1S/C18H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-21-17-15-18(19)20-2/h3-17H2,1-2H3 |
| InChIKey | MEAJTVDNJOGGJW-UHFFFAOYSA-N |
| SMILES | C(=O)(CCOCCCCCCCCCCCCCC)OC |
| Spectrum/Structure Validation Score (Raman) | 0.972339 |