| SpectraBase Spectrum ID |
L8tXL5FaA7m |
| Name |
3-quinolinecarboxylic acid, 7-[4-[[(2-bromobenzoyl)amino]carbonothioyl]-1-piperazinyl]-1-ethyl-6-fluoro-1,4-dihydro-4- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
560.052917537 u |
| Formula |
C24H22BrFN4O4S |
| InChI |
InChI=1S/C24H22BrFN4O4S/c1-2-28-13-16(23(33)34)21(31)15-11-18(26)20(12-19(15)28)29-7-9-30(10-8-29)24(35)27-22(32)14-5-3-4-6-17(14)25/h3-6,11-13H,2,7-10H2,1H3,(H,33,34)(H,27,32,35) |
| InChIKey |
KHDBEWKALZMIDG-UHFFFAOYSA-N |
| Molecular Weight |
561.426 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14936 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11210467; Lab Info: OBK; Lab Number: OBK-cor3640 |
![3-quinolinecarboxylic acid, 7-[4-[[(2-bromobenzoyl)amino]carbonothioyl]-1-piperazinyl]-1-ethyl-6-fluoro-1,4-dihydro-4-](/api/spectrum/L8tXL5FaA7m/structure.png?h=300&w=458 "3-quinolinecarboxylic acid, 7-[4-[[(2-bromobenzoyl)amino]carbonothioyl]-1-piperazinyl]-1-ethyl-6-fluoro-1,4-dihydro-4-")
