| SpectraBase Compound ID | 9yMnB8ejz0O |
|---|---|
| InChI | InChI=1S/C22H16N2/c1-4-10-17(11-5-1)20-21(18-12-6-2-7-13-18)23-16-24-22(20)19-14-8-3-9-15-19/h1-16H |
| InChIKey | ZBFZQSFGTOEYJS-UHFFFAOYSA-N |
| Mol Weight | 308.38 g/mol |
| Molecular Formula | C22H16N2 |
| Exact Mass | 308.131349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6K7nGBtyF7m |
|---|---|
| Name | Pyrimidine, 4,5,6-triphenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.131348523 u |
| Formula | C22H16N2 |
| InChI | InChI=1S/C22H16N2/c1-4-10-17(11-5-1)20-21(18-12-6-2-7-13-18)23-16-24-22(20)19-14-8-3-9-15-19/h1-16H |
| InChIKey | ZBFZQSFGTOEYJS-UHFFFAOYSA-N |
| SMILES | C1(=C(N=CN=C1C1=CC=CC=C1)C=1C=CC=CC1)C=1C=CC=CC1 |