| SpectraBase Compound ID | 3Zs5vUDKIhh |
|---|---|
| InChI | InChI=1S/C19H26ClFO4/c1-2-3-4-5-6-7-13-24-18(22)11-12-19(23)25-14-15-16(20)9-8-10-17(15)21/h8-10H,2-7,11-14H2,1H3 |
| InChIKey | IALFFERNZVBKHR-UHFFFAOYSA-N |
| Mol Weight | 372.86 g/mol |
| Molecular Formula | C19H26ClFO4 |
| Exact Mass | 372.150365 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 | 6NxWd8VySo5 |
|---|---|
| Name | Succinic acid, 2-chloro-6-fluorobenzyl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.150365176 u |
| Formula | C19H26ClFO4 |
| InChI | InChI=1S/C19H26ClFO4/c1-2-3-4-5-6-7-13-24-18(22)11-12-19(23)25-14-15-16(20)9-8-10-17(15)21/h8-10H,2-7,11-14H2,1H3 |
| InChIKey | IALFFERNZVBKHR-UHFFFAOYSA-N |
| Molecular Weight | 372.864 g/mol |
| SMILES | C1=CC(=C(C(=C1)Cl)COC(=O)CCC(OCCCCCCCC)=O)F |