![1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-3-propylpyrazole-4-carboxylic acid, ethyl ester](/api/spectrum/HqD8Qp5ZCuH/structure.png?h=300&w=458 "1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-3-propylpyrazole-4-carboxylic acid, ethyl ester")
| SpectraBase Compound ID | 9kspy6M1mpV |
|---|---|
| InChI | InChI=1S/C20H19ClFN3O4/c1-4-7-15-12(20(27)28-5-2)10-25(23-15)19(26)16-11(3)29-24-18(16)17-13(21)8-6-9-14(17)22/h6,8-10H,4-5,7H2,1-3H3 |
| InChIKey | QPNXMBMSNSETCT-UHFFFAOYSA-N |
| Mol Weight | 419.84 g/mol |
| Molecular Formula | C20H19ClFN3O4 |
| Exact Mass | 419.104812 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HqD8Qp5ZCuH |
|---|---|
| Name | 1-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carbonyl}-3-propylpyrazole-4-carboxylic acid, ethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H19ClFN3O4 |
| InChI | InChI=1S/C20H19ClFN3O4/c1-4-7-15-12(20(27)28-5-2)10-25(23-15)19(26)16-11(3)29-24-18(16)17-13(21)8-6-9-14(17)22/h6,8-10H,4-5,7H2,1-3H3 |
| InChIKey | QPNXMBMSNSETCT-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56688M |
| Solvent | CDCl3 |