| SpectraBase Compound ID | BPjeaj0tcjl |
|---|---|
| InChI | InChI=1S/C17H12N4/c18-11-15-16(14-9-5-2-6-10-14)20-21-17(15)19-12-13-7-3-1-4-8-13/h1-10,12H,(H,20,21)/b19-12+ |
| InChIKey | FEIBOBMWRWIMTN-XDHOZWIPSA-N |
| Mol Weight | 272.31 g/mol |
| Molecular Formula | C17H12N4 |
| Exact Mass | 272.106196 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 | LV06Dzyyy08 |
|---|---|
| Name | 3-(Benzylideneamino)-5-phenyl-1H-pyrazole-4-carbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.106196402 u |
| Formula | C17H12N4 |
| InChI | InChI=1S/C17H12N4/c18-11-15-16(14-9-5-2-6-10-14)20-21-17(15)19-12-13-7-3-1-4-8-13/h1-10,12H,(H,20,21)/b19-12+ |
| InChIKey | FEIBOBMWRWIMTN-XDHOZWIPSA-N |
| SMILES | C1(=C(NN=C1\N=C\C=1C=CC=CC1)C1=CC=CC=C1)C#N |