| SpectraBase Compound ID | BjdfOZlojb3 |
|---|---|
| InChI | InChI=1S/C14H12N4/c15-14-9-13(11-5-4-8-16-10-11)17-18(14)12-6-2-1-3-7-12/h1-10H,15H2 |
| InChIKey | WNDRYBHNLPLQJE-UHFFFAOYSA-N |
| Mol Weight | 236.28 g/mol |
| Molecular Formula | C14H12N4 |
| Exact Mass | 236.106196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L9jwD7gTDRl |
|---|---|
| Name | 5-Amino-1-phenyl-3-(pyridin-3-yl)-1H-pyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.106196402 u |
| Formula | C14H12N4 |
| InChI | InChI=1S/C14H12N4/c15-14-9-13(11-5-4-8-16-10-11)17-18(14)12-6-2-1-3-7-12/h1-10H,15H2 |
| InChIKey | WNDRYBHNLPLQJE-UHFFFAOYSA-N |
| Molecular Weight | 236.278 g/mol |
| SMILES | C=1(N(N=C(C1)C=1C=NC=CC1)C=1C=CC=CC1)N |