| SpectraBase Compound ID | 2t3rh9tMUUk |
|---|---|
| InChI | InChI=1S/C20H35ClO4/c1-2-3-4-5-6-7-8-11-15-24-19(22)17-12-9-10-13-18(17)20(23)25-16-14-21/h17-18H,2-16H2,1H3 |
| InChIKey | PUJAQOQDZOIRHH-UHFFFAOYSA-N |
| Mol Weight | 374.9 g/mol |
| Molecular Formula | C20H35ClO4 |
| Exact Mass | 374.222387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IhR3QCcsL4D |
|---|---|
| Name | 1,2-Cyclohexanedicarboxylic acid, 2-chloroethyl decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.222387303 u |
| Formula | C20H35ClO4 |
| InChI | InChI=1S/C20H35ClO4/c1-2-3-4-5-6-7-8-11-15-24-19(22)17-12-9-10-13-18(17)20(23)25-16-14-21/h17-18H,2-16H2,1H3 |
| InChIKey | PUJAQOQDZOIRHH-UHFFFAOYSA-N |
| Molecular Weight | 374.949 g/mol |
| SMILES | C1CC(C(CC1)C(=O)OCCCl)C(OCCCCCCCCCC)=O |