| SpectraBase Compound ID | 9kkTsSRKqK6 |
|---|---|
| InChI | InChI=1S/C16H22N2/c1-4-5-9-15-12-17-18(13(2)3)16(15)14-10-7-6-8-11-14/h6-8,10-13H,4-5,9H2,1-3H3 |
| InChIKey | CFEUOMVVIQNDTK-UHFFFAOYSA-N |
| Mol Weight | 242.37 g/mol |
| Molecular Formula | C16H22N2 |
| Exact Mass | 242.178299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GmPPUX39I7e |
|---|---|
| Name | 4-Butyl-5-phenyl-1-propan-2-yl-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.178298716 u |
| Formula | C16H22N2 |
| InChI | InChI=1S/C16H22N2/c1-4-5-9-15-12-17-18(13(2)3)16(15)14-10-7-6-8-11-14/h6-8,10-13H,4-5,9H2,1-3H3 |
| InChIKey | CFEUOMVVIQNDTK-UHFFFAOYSA-N |
| Molecular Weight | 242.366 g/mol |
| SMILES | C1=NN(C(=C1CCCC)C=1C=CC=CC1)C(C)C |