| SpectraBase Compound ID | 6ca0LHAhXQx |
|---|---|
| InChI | InChI=1S/C16H19ClF2O4/c17-7-3-1-2-4-8-22-15(20)5-6-16(21)23-14-10-12(18)9-13(19)11-14/h9-11H,1-8H2 |
| InChIKey | FOTKYZDDEIFNKA-UHFFFAOYSA-N |
| Mol Weight | 348.77 g/mol |
| Molecular Formula | C16H19ClF2O4 |
| Exact Mass | 348.093993 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 | 2iLPpqJkjrv |
|---|---|
| Name | Succinic acid, 3,5-difluorophenyl 6-chlorohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.093993114 u |
| Formula | C16H19ClF2O4 |
| InChI | InChI=1S/C16H19ClF2O4/c17-7-3-1-2-4-8-22-15(20)5-6-16(21)23-14-10-12(18)9-13(19)11-14/h9-11H,1-8H2 |
| InChIKey | FOTKYZDDEIFNKA-UHFFFAOYSA-N |
| Molecular Weight | 348.774 g/mol |
| SMILES | C(Cl)CCCCCOC(CCC(OC1=CC(=CC(=C1)F)F)=O)=O |