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2-(2',6'-Dimethylphenyl)-1,10-phenanthroline
SpectraBase Compound ID 72MnyNhkVSo
InChI InChI=1S/C20H16N2/c1-13-5-3-6-14(2)18(13)17-11-10-16-9-8-15-7-4-12-21-19(15)20(16)22-17/h3-12H,1-2H3
InChIKey QECOZTXIYOFOIZ-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C20H16N2
Exact Mass 284.131349 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L2BgR1DLIb9
Name 2-(2',6'-Dimethylphenyl)-1,10-phenanthroline
Comments Computed using HOSE algorithm
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Exact Mass 284.131348523 u
Formula C20H16N2
InChI InChI=1S/C20H16N2/c1-13-5-3-6-14(2)18(13)17-11-10-16-9-8-15-7-4-12-21-19(15)20(16)22-17/h3-12H,1-2H3
InChIKey QECOZTXIYOFOIZ-UHFFFAOYSA-N
Molecular Weight 284.362 g/mol
SMILES C=1(N=C2C(=CC1)C=CC1=CC=CN=C21)C=1C(=CC=CC1C)C