| SpectraBase Spectrum ID |
K3c0vs1MLN3 |
| Name |
6-Chloro-4-(4-chlorophenyl)-3-((4-fluorophenyl)sulfonyl)-quinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H12Cl2FNO2S |
| InChI |
InChI=1S/C21H12Cl2FNO2S/c22-14-3-1-13(2-4-14)21-18-11-15(23)5-10-19(18)25-12-20(21)28(26,27)17-8-6-16(24)7-9-17/h1-12H |
| InChIKey |
KKSHKWLTQLJETO-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b01858 |
| Molecular Weight |
432.296 g/mol |
| Reported Formula |
C21H12O2NCl2FS |
| SMILES |
c1(ccc2c(c1)c(c(cn2)S(c1ccc(cc1)F)(=O)=O)-c1ccc(cc1)Cl)Cl |
| SPLASH |
splash10-001i-0061900000-7434a7f6ec1aec3c638a |
| Source of Spectrum |
AF-60-2480-18 |
| Wiley ID |
1865615 |
