| SpectraBase Compound ID | IBYCsc7RCkJ |
|---|---|
| InChI | InChI=1S/C19H36Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-19(22)18(20)21/h18H,2-17H2,1H3 |
| InChIKey | YSPASYBIZCABDF-UHFFFAOYSA-N |
| Mol Weight | 367.4 g/mol |
| Molecular Formula | C19H36Cl2O2 |
| Exact Mass | 366.209236 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7UNeJ0emHHa |
|---|---|
| Name | Dichloroacetic acid, heptadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.209235797 u |
| Formula | C19H36Cl2O2 |
| InChI | InChI=1S/C19H36Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-19(22)18(20)21/h18H,2-17H2,1H3 |
| InChIKey | YSPASYBIZCABDF-UHFFFAOYSA-N |
| Molecular Weight | 367.401 g/mol |
| SMILES | C(CCCCCCCCCCCC)CCCCOC(C(Cl)Cl)=O |