| SpectraBase Spectrum ID |
9UPTO7cHS2F |
| Name |
3-((3,5-Difluorophenyl)sulfonyl)-8-fluoro-4-(4-fluorophenyl)-quinoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H11F4NO2S |
| InChI |
InChI=1S/C21H11F4NO2S/c22-13-6-4-12(5-7-13)20-17-2-1-3-18(25)21(17)26-11-19(20)29(27,28)16-9-14(23)8-15(24)10-16/h1-11H |
| InChIKey |
TUYNCXNLDTZQCP-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b01858 |
| Molecular Weight |
417.378 g/mol |
| Reported Formula |
C21H11O2NF4S |
| SMILES |
c1cc(c2c(c1)c(c(cn2)S(c1cc(cc(c1)F)F)(=O)=O)-c1ccc(cc1)F)F |
| SPLASH |
splash10-014i-0061900000-f78cb87679002272d19b |
| Source of Spectrum |
AF-60-2481-34 |
| Wiley ID |
1865631 |
