| SpectraBase Compound ID | 8DGbfeTbzoM |
|---|---|
| InChI | InChI=1S/C14H17FN2/c1-10-9-14(13-7-5-4-6-8-13)17(16-10)12(3)11(2)15/h4-9,11-12H,1-3H3 |
| InChIKey | BIHROWNPLAXRQD-UHFFFAOYSA-N |
| Mol Weight | 232.3 g/mol |
| Molecular Formula | C14H17FN2 |
| Exact Mass | 232.137577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | SPWLtgEcwZ |
|---|---|
| Name | 1-(3-Fluorobut-2-yl)-3-methyl-5-phenylpyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.137576718 u |
| Formula | C14H17FN2 |
| InChI | InChI=1S/C14H17FN2/c1-10-9-14(13-7-5-4-6-8-13)17(16-10)12(3)11(2)15/h4-9,11-12H,1-3H3 |
| InChIKey | BIHROWNPLAXRQD-UHFFFAOYSA-N |
| Molecular Weight | 232.302 g/mol |
| SMILES | C1(=NN(C(=C1)c1ccccc1)C(C)C(F)C)C |