| SpectraBase Compound ID | DwiYGL1cFoD |
|---|---|
| InChI | InChI=1S/C16H19Cl3O4/c1-2-3-4-5-10-22-13(20)8-9-14(21)23-16-12(18)7-6-11(17)15(16)19/h6-7H,2-5,8-10H2,1H3 |
| InChIKey | WJUQYRSXVMOFHU-UHFFFAOYSA-N |
| Mol Weight | 381.68 g/mol |
| Molecular Formula | C16H19Cl3O4 |
| Exact Mass | 380.034892 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 | JHlMNPHXdx8 |
|---|---|
| Name | Succinic acid, hexyl 2,3,6-trichlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 380.034892188 u |
| Formula | C16H19Cl3O4 |
| InChI | InChI=1S/C16H19Cl3O4/c1-2-3-4-5-10-22-13(20)8-9-14(21)23-16-12(18)7-6-11(17)15(16)19/h6-7H,2-5,8-10H2,1H3 |
| InChIKey | WJUQYRSXVMOFHU-UHFFFAOYSA-N |
| Molecular Weight | 381.683 g/mol |
| SMILES | C(C(OC1=C(C=CC(=C1Cl)Cl)Cl)=O)CC(OCCCCCC)=O |