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6-([1,1'-biphenyl]-4-yl)-2-amino-4-(3,4-dimethoxyphenyl)nicotinonitrile
SpectraBase Compound ID 6F2bjpuBFut
InChI InChI=1S/C26H21N3O2/c1-30-24-13-12-20(14-25(24)31-2)21-15-23(29-26(28)22(21)16-27)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-15H,1-2H3,(H2,28,29)
InChIKey FLOLENUONRLLQX-UHFFFAOYSA-N
Mol Weight 407.47 g/mol
Molecular Formula C26H21N3O2
Exact Mass 407.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5c9csuRQcnN
Name 6-([1,1'-biphenyl]-4-yl)-2-amino-4-(3,4-dimethoxyphenyl)nicotinonitrile
Appearance Buff crystals
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Formula C26H21N3O2
InChI InChI=1S/C26H21N3O2/c1-30-24-13-12-20(14-25(24)31-2)21-15-23(29-26(28)22(21)16-27)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-15H,1-2H3,(H2,28,29)
InChIKey FLOLENUONRLLQX-UHFFFAOYSA-N
Instrument Name Shimadzu QP-1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4017
Molecular Weight 407.473 g/mol
SMILES Nc1c(c(cc(-c2ccc(cc2)-c2ccccc2)n1)-c1cc(c(cc1)OC)OC)C#N
SPLASH splash10-0a4i-0002900000-9b9c72d0265620736e59
Source of Spectrum Y-57-SM8-4
Wiley ID 1860301