| SpectraBase Spectrum ID |
7exuSh5jukq |
| Name |
7-Chloro-4-(5-(dichloromethyl)-3-(4-(4-fluorophenyl)piperazin-1-yl)-4-nitro-1H-pyrazol-1-yl)quinoline |
| Appearance |
Orange solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
534.054085105 u |
| Formula |
C23H18Cl3FN6O2 |
| InChI |
InChI=1S/C23H18Cl3FN6O2/c24-14-1-6-17-18(13-14)28-8-7-19(17)32-20(22(25)26)21(33(34)35)23(29-32)31-11-9-30(10-12-31)16-4-2-15(27)3-5-16/h1-8,13,22H,9-12H2 |
| InChIKey |
YIZFUKSVZQTWTJ-UHFFFAOYSA-N |
| Instrument Name |
Hewlett-Packard 5989B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.18.54 |
| Molecular Weight |
535.794 g/mol |
| Quality |
126 |
| Reported Formula |
C23H18Cl3FN6O2 |
| SMILES |
C12=C(C=CN=C2C=C(C=C1)Cl)N1N=C(C(=C1C(Cl)Cl)[N+]([O-])=O)N1CCN(CC1)C1=CC=C(C=C1)F |
| SPLASH |
splash10-00di-0900040000-e059171107e8471da849 |
| Source of Spectrum |
BJO-18-SM15-5k (DOI: 10.3762/bjoc.18.54) |
| Wiley ID |
1901308 |
