![2-(5-bromo-2-thienyl)-N-{3-[butyl(methyl)amino]propyl}-4-quinolinecarboxamide](/api/spectrum/4ILNILAcwLf/structure.png?h=300&w=458 "2-(5-bromo-2-thienyl)-N-{3-[butyl(methyl)amino]propyl}-4-quinolinecarboxamide")
| SpectraBase Compound ID | 3NpvRd4tSPv |
|---|---|
| InChI | InChI=1S/C22H26BrN3OS/c1-3-4-13-26(2)14-7-12-24-22(27)17-15-19(20-10-11-21(23)28-20)25-18-9-6-5-8-16(17)18/h5-6,8-11,15H,3-4,7,12-14H2,1-2H3,(H,24,27) |
| InChIKey | YTIQOWDFOYKMNU-UHFFFAOYSA-N |
| Mol Weight | 460.43 g/mol |
| Molecular Formula | C22H26BrN3OS |
| Exact Mass | 459.097997 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 4ILNILAcwLf |
|---|---|
| Name | 2-(5-bromo-2-thienyl)-N-{3-[butyl(methyl)amino]propyl}-4-quinolinecarboxamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 459.097996642 u |
| Formula | C22H26BrN3OS |
| InChI | InChI=1S/C22H26BrN3OS/c1-3-4-13-26(2)14-7-12-24-22(27)17-15-19(20-10-11-21(23)28-20)25-18-9-6-5-8-16(17)18/h5-6,8-11,15H,3-4,7,12-14H2,1-2H3,(H,24,27) |
| InChIKey | YTIQOWDFOYKMNU-UHFFFAOYSA-N |
| Molecular Weight | 460.434 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_5073 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12318282 |