| SpectraBase Compound ID | 8dJ9cWwXmms |
|---|---|
| InChI | InChI=1S/C24H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-27-24(26)20-19-23(25)22-17-14-13-15-18-22/h13-15,17-18H,2-12,16,19-21H2,1H3 |
| InChIKey | YOEZMNOCRCZZST-UHFFFAOYSA-N |
| Mol Weight | 374.6 g/mol |
| Molecular Formula | C24H38O3 |
| Exact Mass | 374.282095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9iaywWfJxUU |
|---|---|
| Name | 4-oxo-4-Phenylbutyric acid, tetradecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.282095081 u |
| Formula | C24H38O3 |
| InChI | InChI=1S/C24H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-27-24(26)20-19-23(25)22-17-14-13-15-18-22/h13-15,17-18H,2-12,16,19-21H2,1H3 |
| InChIKey | YOEZMNOCRCZZST-UHFFFAOYSA-N |
| Molecular Weight | 374.565 g/mol |
| SMILES | C(C(OCCCCCCCCCCCCCC)=O)CC(C=1C=CC=CC1)=O |