| SpectraBase Compound ID | U8vgawBrtU |
|---|---|
| InChI | InChI=1S/C13H7ClF2O2/c14-8-4-6-9(7-5-8)18-13(17)12-10(15)2-1-3-11(12)16/h1-7H |
| InChIKey | AQUGJAIAJWQALG-UHFFFAOYSA-N |
| Mol Weight | 268.65 g/mol |
| Molecular Formula | C13H7ClF2O2 |
| Exact Mass | 268.010263 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XFTLgsrt4q |
|---|---|
| Name | 2,6-Difluorobenzoic acid, 4-chlorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.010263489 u |
| Formula | C13H7ClF2O2 |
| InChI | InChI=1S/C13H7ClF2O2/c14-8-4-6-9(7-5-8)18-13(17)12-10(15)2-1-3-11(12)16/h1-7H |
| InChIKey | AQUGJAIAJWQALG-UHFFFAOYSA-N |
| Molecular Weight | 268.647 g/mol |
| SMILES | C1=CC=C(C(=C1F)C(OC1=CC=C(C=C1)Cl)=O)F |