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4-(4-Bromophenyl)-2-(4-nitrophenyl)-6-phenylpyrimidine

View entire compound with spectra: 1 NMR

4-(4-Bromophenyl)-2-(4-nitrophenyl)-6-phenylpyrimidine
SpectraBase Compound ID 82cDMAxtdNn
InChI InChI=1S/C22H14BrN3O2/c23-18-10-6-16(7-11-18)21-14-20(15-4-2-1-3-5-15)24-22(25-21)17-8-12-19(13-9-17)26(27)28/h1-14H
InChIKey XDTUPMOYWQAJGO-UHFFFAOYSA-N
Mol Weight 432.28 g/mol
Molecular Formula C22H14BrN3O2
Exact Mass 431.02694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9giUP1j3NcQ
Name 4-(4-Bromophenyl)-2-(4-nitrophenyl)-6-phenylpyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 431.026939701 u
Formula C22H14BrN3O2
InChI InChI=1S/C22H14BrN3O2/c23-18-10-6-16(7-11-18)21-14-20(15-4-2-1-3-5-15)24-22(25-21)17-8-12-19(13-9-17)26(27)28/h1-14H
InChIKey XDTUPMOYWQAJGO-UHFFFAOYSA-N
Molecular Weight 432.277 g/mol
SMILES C1(=NC(=CC(=N1)C1=CC=C(C=C1)Br)C1=CC=CC=C1)C1=CC=C(C=C1)N(=O)=O