| SpectraBase Compound ID | IgPhC49mo3X |
|---|---|
| InChI | InChI=1S/C18H16N2O2/c1-22-17-9-7-15(8-10-17)18-16(13-21)12-20(19-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3 |
| InChIKey | OJVQNMHGTRCERS-UHFFFAOYSA-N |
| Mol Weight | 292.34 g/mol |
| Molecular Formula | C18H16N2O2 |
| Exact Mass | 292.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7GGs9b1rvRz |
|---|---|
| Name | 1-Benzyl-3-(4-methoxyphenyl)-1H-pyrazole-4-carbaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.121177761 u |
| Formula | C18H16N2O2 |
| InChI | InChI=1S/C18H16N2O2/c1-22-17-9-7-15(8-10-17)18-16(13-21)12-20(19-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3 |
| InChIKey | OJVQNMHGTRCERS-UHFFFAOYSA-N |
| SMILES | C=1(C(=NN(C1)CC1=CC=CC=C1)C=1C=CC(=CC1)OC)C=O |