| SpectraBase Spectrum ID |
ENnBx2eQpC9 |
| Name |
(E)-3,5-Diphenyl-1-(3,3,3-trifluoroprop-1-en-1-yl)-1H-pyrazole |
| Appearance |
White powder |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.103082916 u |
| Formula |
C18H13F3N2 |
| GC Column |
HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C18H13F3N2/c19-18(20,21)11-12-23-17(15-9-5-2-6-10-15)13-16(22-23)14-7-3-1-4-8-14/h1-13H/b12-11+ |
| InChIKey |
YIUMDVBOPYDTCN-VAWYXSNFSA-N |
| Instrument Name |
Agilent 6890N-Agilent 5973 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202102840 |
| Molecular Weight |
314.311 g/mol |
| Quality |
341 |
| Reported Formula |
C18H13F3N2 |
| SMILES |
C1(=CC=CC=C1)C1=CC(=NN1\C=C\C(F)(F)F)C1=CC=CC=C1 |
| SPLASH |
splash10-03dj-4908000000-b2e8db0c03b858938643 |
| Source of Spectrum |
QE-27-SM21-7 (DOI: 10.1002/chem.202102840) |
| Thin-Layer Chromatography |
0.68 (hexanes/EtOAc, 5:1) |
| Wiley ID |
1904259 |
