| SpectraBase Compound ID | HVEG1CojKdm |
|---|---|
| InChI | InChI=1S/C20H13N5/c21-12-18-17(15-5-3-7-22-13-15)11-19(16-6-4-8-23-14-16)24-20(18)25-9-1-2-10-25/h1-11,13-14H |
| InChIKey | PVGPUDZJFKEODR-UHFFFAOYSA-N |
| Mol Weight | 323.36 g/mol |
| Molecular Formula | C20H13N5 |
| Exact Mass | 323.117095 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 13quJZkulVy |
|---|---|
| Name | 4,6-di-3-Pyridyl-2-(pyrrol-1-yl)nicotinonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.117095439 u |
| Formula | C20H13N5 |
| InChI | InChI=1S/C20H13N5/c21-12-18-17(15-5-3-7-22-13-15)11-19(16-6-4-8-23-14-16)24-20(18)25-9-1-2-10-25/h1-11,13-14H |
| InChIKey | PVGPUDZJFKEODR-UHFFFAOYSA-N |
| Molecular Weight | 323.359 g/mol |
| SMILES | C1=C(C(=C(N=C1C=1C=NC=CC1)N1C=CC=C1)C#N)C=1C=NC=CC1 |