![7-Chloro-4-[3-bromo-1-methylpropylamino]quinoline](/api/spectrum/DZr3VDvsz0Y/structure.png?h=300&w=458 "7-Chloro-4-[3-bromo-1-methylpropylamino]quinoline")
| SpectraBase Compound ID | LwO0BKw1ofL |
|---|---|
| InChI | InChI=1S/C13H14BrClN2/c1-9(4-6-14)17-12-5-7-16-13-8-10(15)2-3-11(12)13/h2-3,5,7-9H,4,6H2,1H3,(H,16,17) |
| InChIKey | FDDCHGZBSQSTOZ-UHFFFAOYSA-N |
| Mol Weight | 313.63 g/mol |
| Molecular Formula | C13H14BrClN2 |
| Exact Mass | 312.002889 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 | DZr3VDvsz0Y |
|---|---|
| Name | 7-Chloro-4-[3-bromo-1-methylpropylamino]quinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.002889159 u |
| Formula | C13H14BrClN2 |
| InChI | InChI=1S/C13H14BrClN2/c1-9(4-6-14)17-12-5-7-16-13-8-10(15)2-3-11(12)13/h2-3,5,7-9H,4,6H2,1H3,(H,16,17) |
| InChIKey | FDDCHGZBSQSTOZ-UHFFFAOYSA-N |
| Molecular Weight | 313.626 g/mol |
| SMILES | C(Br)CC(C)NC=1C=CN=C2C1C=CC(Cl)=C2 |