SpectraBase Spectrum ID |
58HeVcqywEl |
Name |
3-(o-tolyl)-5-(p-tolyl)-1-[(E)-3,3,3-trifluoroprop-1-enyl]pyrazole |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.134383044 u |
Formula |
C20H17F3N2 |
GC Column |
HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
InChI |
InChI=1S/C20H17F3N2/c1-14-7-9-16(10-8-14)19-13-18(17-6-4-3-5-15(17)2)24-25(19)12-11-20(21,22)23/h3-13H,1-2H3/b12-11+ |
InChIKey |
QQJXPWQCMFKRIF-VAWYXSNFSA-N |
Instrument Name |
Agilent 6890N-Agilent 5973 |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/chem.202102840 |
Molecular Weight |
342.365 g/mol |
Quality |
234 |
Reported Formula |
C20H17N2F3 |
SMILES |
C1(=C(C=CC=C1)C)C=1C=C(N(N1)\C=C\C(F)(F)F)C1=CC=C(C=C1)C |
SPLASH |
splash10-0006-1359000000-743bfb31fab2a79f00e6 |
Source of Spectrum |
QE-27-SM30-19b (DOI: 10.1002/chem.202102840) |
Wiley ID |
1904224 |