| SpectraBase Compound ID | ICYMX6Q7Win |
|---|---|
| InChI | InChI=1S/C22H35ClO2/c1-3-5-6-7-8-9-10-11-12-16-19(15-4-2)25-22(24)20-17-13-14-18-21(20)23/h13-14,17-19H,3-12,15-16H2,1-2H3 |
| InChIKey | LFJPOYLNCYQVMI-UHFFFAOYSA-N |
| Mol Weight | 367.0 g/mol |
| Molecular Formula | C22H35ClO2 |
| Exact Mass | 366.232558 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 | 14dbuCjrQ3x |
|---|---|
| Name | 2-Chlorobenzoic acid, 4-pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.232558065 u |
| Formula | C22H35ClO2 |
| InChI | InChI=1S/C22H35ClO2/c1-3-5-6-7-8-9-10-11-12-16-19(15-4-2)25-22(24)20-17-13-14-18-21(20)23/h13-14,17-19H,3-12,15-16H2,1-2H3 |
| InChIKey | LFJPOYLNCYQVMI-UHFFFAOYSA-N |
| Molecular Weight | 366.973 g/mol |
| SMILES | C1=CC=C(C(=C1)Cl)C(OC(CCCCCCCCCCC)CCC)=O |