| SpectraBase Compound ID | FMhVjppGpoW |
|---|---|
| InChI | InChI=1S/C18H26O3/c1-2-3-4-5-6-10-15-21-18(20)14-13-17(19)16-11-8-7-9-12-16/h7-9,11-12H,2-6,10,13-15H2,1H3 |
| InChIKey | IZNTVVKVZSOEJM-UHFFFAOYSA-N |
| Mol Weight | 290.4 g/mol |
| Molecular Formula | C18H26O3 |
| Exact Mass | 290.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GbSPkijCskO |
|---|---|
| Name | 4-oxo-4-Phenylbutyric acid, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.188194694 u |
| Formula | C18H26O3 |
| InChI | InChI=1S/C18H26O3/c1-2-3-4-5-6-10-15-21-18(20)14-13-17(19)16-11-8-7-9-12-16/h7-9,11-12H,2-6,10,13-15H2,1H3 |
| InChIKey | IZNTVVKVZSOEJM-UHFFFAOYSA-N |
| Molecular Weight | 290.403 g/mol |
| SMILES | C(C(OCCCCCCCC)=O)CC(C=1C=CC=CC1)=O |