| SpectraBase Compound ID | 27D6kMAwAQm |
|---|---|
| InChI | InChI=1S/C24H40O2/c1-2-3-4-5-6-7-8-9-10-11-17-22-26-24(25)21-16-15-20-23-18-13-12-14-19-23/h12-14,18-19H,2-11,15-17,20-22H2,1H3 |
| InChIKey | FVJLOOXMSXBFRL-UHFFFAOYSA-N |
| Mol Weight | 360.6 g/mol |
| Molecular Formula | C24H40O2 |
| Exact Mass | 360.302831 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 | 8Zl0b1aVqXe |
|---|---|
| Name | 5-Phenylvaleric acid, tridecyl 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/c1-2-3-4-5-6-7-8-9-10-11-17-22-26-24(25)21-16-15-20-23-18-13-12-14-19-23/h12-14,18-19H,2-11,15-17,20-22H2,1H3 |
| InChIKey | FVJLOOXMSXBFRL-UHFFFAOYSA-N |
| Molecular Weight | 360.582 g/mol |
| SMILES | C(CCC(OCCCCCCCCCCCCC)=O)CC=1C=CC=CC1 |