| SpectraBase Compound ID | DLzPuKD4TqI |
|---|---|
| InChI | InChI=1S/C24H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-21-26-24(25)23-19-17-22(16-4-2)18-20-23/h17-20H,3-16,21H2,1-2H3 |
| InChIKey | KHEUTIARXHKJTJ-UHFFFAOYSA-N |
| Mol Weight | 360.6 g/mol |
| Molecular Formula | C24H40O2 |
| Exact Mass | 360.302831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AR9BDyFRXwp |
|---|---|
| Name | Benzoic acid, 4-propyl-, tetradecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.302830526 u |
| Formula | C24H40O2 |
| InChI | InChI=1S/C24H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-21-26-24(25)23-19-17-22(16-4-2)18-20-23/h17-20H,3-16,21H2,1-2H3 |
| InChIKey | KHEUTIARXHKJTJ-UHFFFAOYSA-N |
| Molecular Weight | 360.582 g/mol |
| SMILES | C(OCCCCCCCCCCCCCC)(=O)C1=CC=C(CCC)C=C1 |