| SpectraBase Compound ID | L35tiVzeTVN |
|---|---|
| InChI | InChI=1S/C12H12ClFO4/c13-9-2-1-3-10(8-9)18-12(16)5-4-11(15)17-7-6-14/h1-3,8H,4-7H2 |
| InChIKey | LJEYTRNHKVESAT-UHFFFAOYSA-N |
| Mol Weight | 274.68 g/mol |
| Molecular Formula | C12H12ClFO4 |
| Exact Mass | 274.040815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3gqdQdhjkQF |
|---|---|
| Name | Succinic acid, 3-chlorophenyl 2-fluoroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.040814725 u |
| Formula | C12H12ClFO4 |
| InChI | InChI=1S/C12H12ClFO4/c13-9-2-1-3-10(8-9)18-12(16)5-4-11(15)17-7-6-14/h1-3,8H,4-7H2 |
| InChIKey | LJEYTRNHKVESAT-UHFFFAOYSA-N |
| Molecular Weight | 274.675 g/mol |
| SMILES | C(CC(OC1=CC(=CC=C1)Cl)=O)C(OCCF)=O |