![2-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1-naphthol](/api/spectrum/8NatwXPNOsu/structure.png?h=300&w=458 "2-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1-naphthol")
| SpectraBase Compound ID | CFK57pwZdxL |
|---|---|
| InChI | InChI=1S/C21H18N2O3/c1-25-19-10-8-14(11-20(19)26-2)17-12-18(23-22-17)16-9-7-13-5-3-4-6-15(13)21(16)24/h3-12,24H,1-2H3,(H,22,23) |
| InChIKey | ICXLGEZBHYTHDQ-UHFFFAOYSA-N |
| Mol Weight | 346.39 g/mol |
| Molecular Formula | C21H18N2O3 |
| Exact Mass | 346.131742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8NatwXPNOsu |
|---|---|
| Name | 2-[5-(3,4-Dimethoxyphenyl)-1H-pyrazol-3-yl]-1-naphthol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.131742445 u |
| Formula | C21H18N2O3 |
| InChI | InChI=1S/C21H18N2O3/c1-25-19-10-8-14(11-20(19)26-2)17-12-18(23-22-17)16-9-7-13-5-3-4-6-15(13)21(16)24/h3-12,24H,1-2H3,(H,22,23) |
| InChIKey | ICXLGEZBHYTHDQ-UHFFFAOYSA-N |
| SMILES | N1C(=CC(C2=C(C3=CC=CC=C3C=C2)O)=N1)C1=CC(OC)=C(C=C1)OC |