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1H-Imidazole, 1-[[2-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]oxiranyl]methyl]-
SpectraBase Compound ID Gu0bCMAqhab
InChI InChI=1S/C19H14F4N2O/c20-16-7-5-14(6-8-16)18(11-25-10-9-24-12-25)17(26-18)13-1-3-15(4-2-13)19(21,22)23/h1-10,12,17H,11H2
InChIKey ARPXGMKIKNKNPI-UHFFFAOYSA-N
Mol Weight 362.33 g/mol
Molecular Formula C19H14F4N2O
Exact Mass 362.104226 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AGMGg1TDgNd
Name 1H-Imidazole, 1-[[2-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]oxiranyl]methyl]-
Comments Computed using HOSE algorithm
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Exact Mass 362.104225730 u
Formula C19H14F4N2O
InChI InChI=1S/C19H14F4N2O/c20-16-7-5-14(6-8-16)18(11-25-10-9-24-12-25)17(26-18)13-1-3-15(4-2-13)19(21,22)23/h1-10,12,17H,11H2
InChIKey ARPXGMKIKNKNPI-UHFFFAOYSA-N
Molecular Weight 362.328 g/mol
SMILES C1=C(C=CC(=C1)C1C(C2=CC=C(C=C2)F)(CN2C=CN=C2)O1)C(F)(F)F