![4'-Bromo-[2,2';6',2";6",2"']quaterpyridne](/api/spectrum/IFqy3BUEle8/structure.png?h=300&w=458 "4'-Bromo-[2,2';6',2\";6\",2\"']quaterpyridne")
| SpectraBase Compound ID | JRfPxEY1vkc |
|---|---|
| InChI | InChI=1S/C20H13BrN4/c21-14-12-19(16-7-2-4-11-23-16)25-20(13-14)18-9-5-8-17(24-18)15-6-1-3-10-22-15/h1-13H |
| InChIKey | DHEYAMMWTHBBIY-UHFFFAOYSA-N |
| Mol Weight | 389.26 g/mol |
| Molecular Formula | C20H13BrN4 |
| Exact Mass | 388.032359 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 | IFqy3BUEle8 |
|---|---|
| Name | 4'-Bromo-[2,2';6',2'';6'',2''']quaterpyridne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.032359435 u |
| Formula | C20H13BrN4 |
| InChI | InChI=1S/C20H13BrN4/c21-14-12-19(16-7-2-4-11-23-16)25-20(13-14)18-9-5-8-17(24-18)15-6-1-3-10-22-15/h1-13H |
| InChIKey | DHEYAMMWTHBBIY-UHFFFAOYSA-N |
| Molecular Weight | 389.256 g/mol |
| SMILES | C1(=NC(=CC(=C1)Br)C=1N=CC=CC1)C1=NC(C2=NC=CC=C2)=CC=C1 |