| SpectraBase Compound ID | 7gUgT4xV5qw |
|---|---|
| InChI | InChI=1S/C21H17FN2/c22-19-14-8-7-13-18(19)20-15-21(16-9-3-1-4-10-16)24(23-20)17-11-5-2-6-12-17/h1-14,21H,15H2 |
| InChIKey | LDTBUHRPAFOKQJ-UHFFFAOYSA-N |
| Mol Weight | 316.38 g/mol |
| Molecular Formula | C21H17FN2 |
| Exact Mass | 316.137577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2qFbGoduhla |
|---|---|
| Name | 3-(2'-Fluorophenyl)-1,5-diphenyl-4,5-dihydro-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.137576718 u |
| Formula | C21H17FN2 |
| InChI | InChI=1S/C21H17FN2/c22-19-14-8-7-13-18(19)20-15-21(16-9-3-1-4-10-16)24(23-20)17-11-5-2-6-12-17/h1-14,21H,15H2 |
| InChIKey | LDTBUHRPAFOKQJ-UHFFFAOYSA-N |
| Molecular Weight | 316.379 g/mol |
| SMILES | C1(N(N=C(C1)C=1C(F)=CC=CC1)C=1C=CC=CC1)C=1C=CC=CC1 |