![7-Chloro-4-[1-methyl-4-[N-methyl-N-benzylamino]butylamino]quinoline](/api/spectrum/1r0bAmpMkul/structure.png?h=300&w=458 "7-Chloro-4-[1-methyl-4-[N-methyl-N-benzylamino]butylamino]quinoline")
| SpectraBase Compound ID | B0dUdlg4u0K |
|---|---|
| InChI | InChI=1S/C22H26ClN3/c1-17(7-6-14-26(2)16-18-8-4-3-5-9-18)25-21-12-13-24-22-15-19(23)10-11-20(21)22/h3-5,8-13,15,17H,6-7,14,16H2,1-2H3,(H,24,25) |
| InChIKey | WWYGIZAIIQNKMF-UHFFFAOYSA-N |
| Mol Weight | 367.92 g/mol |
| Molecular Formula | C22H26ClN3 |
| Exact Mass | 367.181526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1r0bAmpMkul |
|---|---|
| Name | 7-Chloro-4-[1-methyl-4-[N-methyl-N-benzylamino]butylamino]quinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.181525549 u |
| Formula | C22H26ClN3 |
| InChI | InChI=1S/C22H26ClN3/c1-17(7-6-14-26(2)16-18-8-4-3-5-9-18)25-21-12-13-24-22-15-19(23)10-11-20(21)22/h3-5,8-13,15,17H,6-7,14,16H2,1-2H3,(H,24,25) |
| InChIKey | WWYGIZAIIQNKMF-UHFFFAOYSA-N |
| Molecular Weight | 367.924 g/mol |
| SMILES | C1=C(C=C2C(=C1)C(=CC=N2)NC(CCCN(CC1=CC=CC=C1)C)C)Cl |