| SpectraBase Compound ID | 7cTuRvaXewC |
|---|---|
| InChI | InChI=1S/C15H16N2O3/c1-10(2)14-9-13(15(18)20-4)16-17(14)11-5-7-12(19-3)8-6-11/h5-9H,1H2,2-4H3 |
| InChIKey | GDKXUUOGKSRFAY-UHFFFAOYSA-N |
| Mol Weight | 272.3 g/mol |
| Molecular Formula | C15H16N2O3 |
| Exact Mass | 272.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2Go77YsLmcv |
|---|---|
| Name | Methyl 1-(4-methoxyphenyl)-5-(prop-1-en-2-yl)pyrazole-3-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.116092380 u |
| Formula | C15H16N2O3 |
| InChI | InChI=1S/C15H16N2O3/c1-10(2)14-9-13(15(18)20-4)16-17(14)11-5-7-12(19-3)8-6-11/h5-9H,1H2,2-4H3 |
| InChIKey | GDKXUUOGKSRFAY-UHFFFAOYSA-N |
| SMILES | C1(=CC=C(C=C1)N1C(=CC(=N1)C(OC)=O)C(=C)C)OC |