| SpectraBase Compound ID | KdeAU1sWhOD |
|---|---|
| InChI | InChI=1S/C22H15N3O2/c26-25(27)19-13-11-18(12-14-19)22-23-20(16-7-3-1-4-8-16)15-21(24-22)17-9-5-2-6-10-17/h1-15H |
| InChIKey | FIVLSZOXESJQCZ-UHFFFAOYSA-N |
| Mol Weight | 353.38 g/mol |
| Molecular Formula | C22H15N3O2 |
| Exact Mass | 353.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dfGALW7BTu |
|---|---|
| Name | 2-(4-Nitrophenyl)-4,6-diphenylpyrimidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.116426733 u |
| Formula | C22H15N3O2 |
| InChI | InChI=1S/C22H15N3O2/c26-25(27)19-13-11-18(12-14-19)22-23-20(16-7-3-1-4-8-16)15-21(24-22)17-9-5-2-6-10-17/h1-15H |
| InChIKey | FIVLSZOXESJQCZ-UHFFFAOYSA-N |
| Molecular Weight | 353.381 g/mol |
| SMILES | C1(=NC(=CC(=N1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(C=C1)N(=O)=O |