| SpectraBase Spectrum ID |
ocgsLMEHUh |
| Name |
6-Chloro-4-(4-chlorophenyl)-8-fluoro-3-((4-fluorophenyl)-sulfonyl)quinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H11Cl2F2NO2S |
| InChI |
InChI=1S/C21H11Cl2F2NO2S/c22-13-3-1-12(2-4-13)20-17-9-14(23)10-18(25)21(17)26-11-19(20)29(27,28)16-7-5-15(24)6-8-16/h1-11H |
| InChIKey |
PJHPBIGHDCTSAF-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b01858 |
| Molecular Weight |
450.287 g/mol |
| Reported Formula |
C21H11O2NCl2F2S |
| SMILES |
c1(cc(c2c(c1)c(c(cn2)S(c1ccc(cc1)F)(=O)=O)-c1ccc(cc1)Cl)F)Cl |
| SPLASH |
splash10-0002-0031900000-7db6e0dc68ea60486fed |
| Source of Spectrum |
AF-60-2480-22 |
| Wiley ID |
1865619 |
