| SpectraBase Compound ID | 3aVdTJgRHoq |
|---|---|
| InChI | InChI=1S/C20H22N2O2/c1-5-18-19(14-8-6-10-16(12-14)23-3)21-22(2)20(18)15-9-7-11-17(13-15)24-4/h6-13H,5H2,1-4H3 |
| InChIKey | LACLGBBYJQAGOG-UHFFFAOYSA-N |
| Mol Weight | 322.41 g/mol |
| Molecular Formula | C20H22N2O2 |
| Exact Mass | 322.168128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eg7GI40dxvj |
|---|---|
| Name | 4-Ethyl-3,5-bis(3-methoxyphenyl)-1-methyl-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.168127954 u |
| Formula | C20H22N2O2 |
| InChI | InChI=1S/C20H22N2O2/c1-5-18-19(14-8-6-10-16(12-14)23-3)21-22(2)20(18)15-9-7-11-17(13-15)24-4/h6-13H,5H2,1-4H3 |
| InChIKey | LACLGBBYJQAGOG-UHFFFAOYSA-N |
| Molecular Weight | 322.408 g/mol |
| SMILES | COC1=CC(=CC=C1)C=1N(N=C(C1CC)C1=CC=CC(=C1)OC)C |