| SpectraBase Spectrum ID |
3nEDTuo1hL0 |
| Name |
3-((3,5-Dichlorophenyl)sulfonyl)-7-fluoro-4-(3-fluorophenyl)-quinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H11Cl2F2NO2S |
| InChI |
InChI=1S/C21H11Cl2F2NO2S/c22-13-7-14(23)9-17(8-13)29(27,28)20-11-26-19-10-16(25)4-5-18(19)21(20)12-2-1-3-15(24)6-12/h1-11H |
| InChIKey |
NIFIYHDIVJVLJH-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 |
c1c(cc2c(c1)c(c(cn2)S(c1cc(cc(c1)Cl)Cl)(=O)=O)-c1cc(ccc1)F)F |
| SPLASH |
splash10-0002-0091700000-d513eade6963c9a99118 |
| Source of Spectrum |
AF-60-2480-26 |
| Wiley ID |
1865623 |
