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2-Methyl-4-phenyl-6-(2-hydroxyphenyl)pyrimidine
SpectraBase Compound ID JZDHsaCxLQn
InChI InChI=1S/C17H14N2O/c1-12-18-15(13-7-3-2-4-8-13)11-16(19-12)14-9-5-6-10-17(14)20/h2-11,20H,1H3
InChIKey ZBTOBDJSNCUGKS-UHFFFAOYSA-N
Mol Weight 262.31 g/mol
Molecular Formula C17H14N2O
Exact Mass 262.110613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bht1G299y03
Name 2-Methyl-4-phenyl-6-(2-hydroxyphenyl)pyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 262.110613078 u
Formula C17H14N2O
InChI InChI=1S/C17H14N2O/c1-12-18-15(13-7-3-2-4-8-13)11-16(19-12)14-9-5-6-10-17(14)20/h2-11,20H,1H3
InChIKey ZBTOBDJSNCUGKS-UHFFFAOYSA-N
Molecular Weight 262.312 g/mol
SMILES C1=C(N=C(N=C1C1=CC=CC=C1)C)C1=C(C=CC=C1)O