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4-(4-Chlorophenyl)-1-(2-methoxyphenethyl)-5-propyl-1H-imidazole
SpectraBase Compound ID 1I6DXiEvIY5
InChI InChI=1S/C21H23ClN2O/c1-3-6-19-21(17-9-11-18(22)12-10-17)23-15-24(19)14-13-16-7-4-5-8-20(16)25-2/h4-5,7-12,15H,3,6,13-14H2,1-2H3
InChIKey KDZCIJVWBSHWBC-UHFFFAOYSA-N
Mol Weight 354.88 g/mol
Molecular Formula C21H23ClN2O
Exact Mass 354.149891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1h02zCPsCQg
Name 4-(4-Chlorophenyl)-1-(2-methoxyphenethyl)-5-propyl-1H-imidazole
Comments Computed using HOSE algorithm
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Exact Mass 354.149891068 u
Formula C21H23ClN2O
InChI InChI=1S/C21H23ClN2O/c1-3-6-19-21(17-9-11-18(22)12-10-17)23-15-24(19)14-13-16-7-4-5-8-20(16)25-2/h4-5,7-12,15H,3,6,13-14H2,1-2H3
InChIKey KDZCIJVWBSHWBC-UHFFFAOYSA-N
Molecular Weight 354.881 g/mol
SMILES C1=NC(=C(N1CCC1=C(C=CC=C1)OC)CCC)C1=CC=C(C=C1)Cl