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2,4,6-Tris(4-methoxyphenyl)pyrimidine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,4,6-Tris(4-methoxyphenyl)pyrimidine
SpectraBase Compound ID 6YOmeQ6W8BN
InChI InChI=1S/C25H22N2O3/c1-28-20-10-4-17(5-11-20)23-16-24(18-6-12-21(29-2)13-7-18)27-25(26-23)19-8-14-22(30-3)15-9-19/h4-16H,1-3H3
InChIKey UETMAIRNWZZFQI-UHFFFAOYSA-N
Mol Weight 398.46 g/mol
Molecular Formula C25H22N2O3
Exact Mass 398.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7QXt70YeAyJ
Name 2,4,6-Tris(4-methoxyphenyl)pyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 398.163042573 u
Formula C25H22N2O3
InChI InChI=1S/C25H22N2O3/c1-28-20-10-4-17(5-11-20)23-16-24(18-6-12-21(29-2)13-7-18)27-25(26-23)19-8-14-22(30-3)15-9-19/h4-16H,1-3H3
InChIKey UETMAIRNWZZFQI-UHFFFAOYSA-N
Molecular Weight 398.462 g/mol
SMILES C=1(N=C(C=C(N1)C=1C=CC(=CC1)OC)C=1C=CC(=CC1)OC)C=1C=CC(=CC1)OC