| SpectraBase Compound ID | DaBlIsaAZsz |
|---|---|
| InChI | InChI=1S/C14H13ClN2O3/c1-3-20-14(19)12-8-13(9(2)18)17(16-12)11-6-4-10(15)5-7-11/h4-8H,3H2,1-2H3 |
| InChIKey | HNORGLHNPFYFSI-UHFFFAOYSA-N |
| Mol Weight | 292.72 g/mol |
| Molecular Formula | C14H13ClN2O3 |
| Exact Mass | 292.06147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3QISZUpab8E |
|---|---|
| Name | Ethyl 5-acetyl-1-p-chlorophenylpyrazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.061469984 u |
| Formula | C14H13ClN2O3 |
| InChI | InChI=1S/C14H13ClN2O3/c1-3-20-14(19)12-8-13(9(2)18)17(16-12)11-6-4-10(15)5-7-11/h4-8H,3H2,1-2H3 |
| InChIKey | HNORGLHNPFYFSI-UHFFFAOYSA-N |
| Molecular Weight | 292.722 g/mol |
| SMILES | C1(=NN(C(=C1)C(=O)C)C=1C=CC(=CC1)Cl)C(=O)OCC |