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3-(2,4-Dimethoxyphenylethyl)-2-(4-nitrophenyl)-4(3H)-pyrido[2,3-d]pyrimidinone
SpectraBase Compound ID 91wvyaPzsUF
InChI InChI=1S/C23H20N4O5/c1-31-18-10-7-15(20(14-18)32-2)11-13-26-22(16-5-8-17(9-6-16)27(29)30)25-21-19(23(26)28)4-3-12-24-21/h3-10,12,14H,11,13H2,1-2H3
InChIKey UJCHLXNMCKXRLG-UHFFFAOYSA-N
Mol Weight 432.44 g/mol
Molecular Formula C23H20N4O5
Exact Mass 432.14337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDHaolmtuwN
Name 3-(2,4-Dimethoxyphenylethyl)-2-(4-nitrophenyl)-4(3H)-pyrido[2,3-d]pyrimidinone
Comments Note: The molecular formula of the structure shown is C23H20N4O5 - which differs from the formula reported for the mass spectrum (C22H18N4O5)
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Formula C22H18N4O5
InChI InChI=1S/C23H20N4O5/c1-31-18-10-7-15(20(14-18)32-2)11-13-26-22(16-5-8-17(9-6-16)27(29)30)25-21-19(23(26)28)4-3-12-24-21/h3-10,12,14H,11,13H2,1-2H3
InChIKey UJCHLXNMCKXRLG-UHFFFAOYSA-N
Molecular Weight 432.436 g/mol
SMILES COc1c(ccc(c1)OC)CCN1C(=Nc2c(C1=O)cccn2)c1ccc(cc1)N(=O)=O
SPLASH splash10-0udi-0910100000-a510b652540159486bbb
Source of Spectrum SO-0-1472-5
Wiley ID 875829