| SpectraBase Compound ID | K0ISTqMPbDc |
|---|---|
| InChI | InChI=1S/C20H31ClO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-23-20(22)18-15-12-13-16-19(18)21/h12-13,15-16H,2-11,14,17H2,1H3 |
| InChIKey | RIBWAZGMFLYEHT-UHFFFAOYSA-N |
| Mol Weight | 338.92 g/mol |
| Molecular Formula | C20H31ClO2 |
| Exact Mass | 338.201258 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 | pWaQVoAukW |
|---|---|
| Name | 2-Chlorobenzoic acid, tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.201257936 u |
| Formula | C20H31ClO2 |
| InChI | InChI=1S/C20H31ClO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-23-20(22)18-15-12-13-16-19(18)21/h12-13,15-16H,2-11,14,17H2,1H3 |
| InChIKey | RIBWAZGMFLYEHT-UHFFFAOYSA-N |
| Molecular Weight | 338.919 g/mol |
| SMILES | C(=O)(OCCCCCCCCCCCCC)C=1C(Cl)=CC=CC1 |