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5-(4-Methoxy-phenyl)-2-(2-nitro-phenyl)-4-phenyl-1H-imidazole
SpectraBase Compound ID BG8a87JE2Rm
InChI InChI=1S/C22H17N3O3/c1-28-17-13-11-16(12-14-17)21-20(15-7-3-2-4-8-15)23-22(24-21)18-9-5-6-10-19(18)25(26)27/h2-14H,1H3,(H,23,24)
InChIKey VWOMWKHGVBMUNZ-UHFFFAOYSA-N
Mol Weight 371.4 g/mol
Molecular Formula C22H17N3O3
Exact Mass 371.126991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3kphQCBov4
Name 5-(4-Methoxy-phenyl)-2-(2-nitro-phenyl)-4-phenyl-1H-imidazole
Comments Computed using HOSE algorithm
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Exact Mass 371.126991416 u
Formula C22H17N3O3
InChI InChI=1S/C22H17N3O3/c1-28-17-13-11-16(12-14-17)21-20(15-7-3-2-4-8-15)23-22(24-21)18-9-5-6-10-19(18)25(26)27/h2-14H,1H3,(H,23,24)
InChIKey VWOMWKHGVBMUNZ-UHFFFAOYSA-N
Molecular Weight 371.396 g/mol
SMILES C=1(N=C(NC1C1=CC=C(C=C1)OC)C1=C(C=CC=C1)N(=O)=O)C1=CC=CC=C1