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1-Allyl-2,4,5-tris(4-methoxyphenyl)imidazole
SpectraBase Compound ID EWw2WDuZ18e
InChI InChI=1S/C27H26N2O3/c1-5-18-29-26(20-8-14-23(31-3)15-9-20)25(19-6-12-22(30-2)13-7-19)28-27(29)21-10-16-24(32-4)17-11-21/h5-17H,1,18H2,2-4H3
InChIKey GTHFPLDLHGRBOC-UHFFFAOYSA-N
Mol Weight 426.52 g/mol
Molecular Formula C27H26N2O3
Exact Mass 426.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID PgzAZD0u2l
Name 1-Allyl-2,4,5-tris(4-methoxyphenyl)imidazole
Comments Computed using HOSE algorithm
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Exact Mass 426.194342702 u
Formula C27H26N2O3
InChI InChI=1S/C27H26N2O3/c1-5-18-29-26(20-8-14-23(31-3)15-9-20)25(19-6-12-22(30-2)13-7-19)28-27(29)21-10-16-24(32-4)17-11-21/h5-17H,1,18H2,2-4H3
InChIKey GTHFPLDLHGRBOC-UHFFFAOYSA-N
Molecular Weight 426.516 g/mol
SMILES C=1(N(C(=C(N1)C=1C=CC(=CC1)OC)C=1C=CC(=CC1)OC)CC=C)C=1C=CC(=CC1)OC