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(E)-4,5-Diphenyl-1-(3,3,3-trifluoroprop-1-en-1-yl)-1H-imidazole
SpectraBase Compound ID Gjv95rPdnbm
InChI InChI=1S/C18H13F3N2/c19-18(20,21)11-12-23-13-22-16(14-7-3-1-4-8-14)17(23)15-9-5-2-6-10-15/h1-13H/b12-11+
InChIKey XQYXAOCMLZWEPG-VAWYXSNFSA-N
Mol Weight 314.31 g/mol
Molecular Formula C18H13F3N2
Exact Mass 314.103083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZbVhADHXbO
Name (E)-4,5-Diphenyl-1-(3,3,3-trifluoroprop-1-en-1-yl)-1H-imidazole
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)11-12-23-13-22-16(14-7-3-1-4-8-14)17(23)15-9-5-2-6-10-15/h1-13H/b12-11+
InChIKey XQYXAOCMLZWEPG-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 246
Reported Formula C18H13N2F3
SMILES C1(=CC=CC=C1)C1=C(N=CN1\C=C\C(F)(F)F)C1=CC=CC=C1
SPLASH splash10-03xr-0439000000-567d332fc930e6c238f0
Source of Spectrum QE-27-SM35-26 (DOI: 10.1002/chem.202102840)
Thin-Layer Chromatography 0.23 (hexanes/EtOAc, 5:1)
Wiley ID 1904230