![ethyl 3-[(3-methoxyanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate](/api/spectrum/2oVjYoqnrfr/structure.png?h=300&w=458 "ethyl 3-[(3-methoxyanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate")
| SpectraBase Compound ID | IelBMgZeaFI |
|---|---|
| InChI | InChI=1S/C15H17N3O4/c1-4-22-15(20)13-9-12(17-18(13)2)14(19)16-10-6-5-7-11(8-10)21-3/h5-9H,4H2,1-3H3,(H,16,19) |
| InChIKey | SGIJKNMLUXWRCL-UHFFFAOYSA-N |
| Mol Weight | 303.32 g/mol |
| Molecular Formula | C15H17N3O4 |
| Exact Mass | 303.121906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2oVjYoqnrfr |
|---|---|
| Name | Ethyl 3-[(3-methoxyanilino)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.121906035 u |
| Formula | C15H17N3O4 |
| InChI | InChI=1S/C15H17N3O4/c1-4-22-15(20)13-9-12(17-18(13)2)14(19)16-10-6-5-7-11(8-10)21-3/h5-9H,4H2,1-3H3,(H,16,19) |
| InChIKey | SGIJKNMLUXWRCL-UHFFFAOYSA-N |
| SMILES | N(C(C=1C=C(N(N1)C)C(=O)OCC)=O)C1=CC(OC)=CC=C1 |