| SpectraBase Compound ID | AjlGTiUvRW5 |
|---|---|
| InChI | InChI=1S/C16H17N3/c1-11-16(17)12(2)19(18-11)10-14-8-5-7-13-6-3-4-9-15(13)14/h3-9H,10,17H2,1-2H3 |
| InChIKey | LCEXUJXGSMXTAR-UHFFFAOYSA-N |
| Mol Weight | 251.33 g/mol |
| Molecular Formula | C16H17N3 |
| Exact Mass | 251.142248 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7IYqpXk4HXi |
|---|---|
| Name | Pyrazol-4-amine, 3,5-dimethyl-1-(1-naphthylmethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.142247559 u |
| Formula | C16H17N3 |
| InChI | InChI=1S/C16H17N3/c1-11-16(17)12(2)19(18-11)10-14-8-5-7-13-6-3-4-9-15(13)14/h3-9H,10,17H2,1-2H3 |
| InChIKey | LCEXUJXGSMXTAR-UHFFFAOYSA-N |
| Molecular Weight | 251.333 g/mol |
| SMILES | C1=CC=C2C(=C1)C=CC=C2CN1C(=C(N)C(=N1)C)C |