| SpectraBase Spectrum ID |
4PFPvgOBHs |
| Name |
(E)-3,5-Bis(4-chlorophenyl)-1-(3,3,3-trifluoroprop-1-en-1-yl)-1H-pyrazole |
| Appearance |
Off-white solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.025138251 u |
| Formula |
C18H11Cl2F3N2 |
| GC Column |
HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C18H11Cl2F3N2/c19-14-5-1-12(2-6-14)16-11-17(13-3-7-15(20)8-4-13)25(24-16)10-9-18(21,22)23/h1-11H/b10-9+ |
| InChIKey |
HJPIKICURKXODH-MDZDMXLPSA-N |
| Instrument Name |
Agilent 6890N-Agilent 5973 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202102840 |
| Molecular Weight |
383.201 g/mol |
| Quality |
448 |
| Reported Formula |
C18H11N2Cl2F3 |
| SMILES |
C1(=CC=C(C=C1)Cl)C1=CC(=NN1\C=C\C(F)(F)F)C1=CC=C(C=C1)Cl |
| SPLASH |
splash10-040r-8935000000-95b506e993afe8376829 |
| Source of Spectrum |
QE-27-SM22-9 (DOI: 10.1002/chem.202102840) |
| Thin-Layer Chromatography |
0.83 (hexanes/EtOAc, 2:1) |
| Wiley ID |
1904261 |
