![Ethyl 5-[p-fluorophenyl]pyrazole-3-carboxylate](/api/spectrum/7T2alKpzDSC/structure.png?h=300&w=458 "Ethyl 5-[p-fluorophenyl]pyrazole-3-carboxylate")
| SpectraBase Compound ID | 6Z7OI7XGOvG |
|---|---|
| InChI | InChI=1S/C12H11FN2O2/c1-2-17-12(16)11-7-10(14-15-11)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3,(H,14,15) |
| InChIKey | XYKNUKFAXFVJRH-UHFFFAOYSA-N |
| Mol Weight | 234.23 g/mol |
| Molecular Formula | C12H11FN2O2 |
| Exact Mass | 234.080456 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7T2alKpzDSC |
|---|---|
| Name | Ethyl 5-[p-fluorophenyl]pyrazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.080455763 u |
| Formula | C12H11FN2O2 |
| InChI | InChI=1S/C12H11FN2O2/c1-2-17-12(16)11-7-10(14-15-11)8-3-5-9(13)6-4-8/h3-7H,2H2,1H3,(H,14,15) |
| InChIKey | XYKNUKFAXFVJRH-UHFFFAOYSA-N |
| Molecular Weight | 234.230 g/mol |
| SMILES | C1=CC(=CC=C1F)C1=CC(=NN1)C(OCC)=O |