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1,4-bis[4-(m-Nitrophenyl)-1,3-butadienyl]benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

1,4-bis[4-(m-Nitrophenyl)-1,3-butadienyl]benzene
SpectraBase Compound ID 79DyU5DWgDB
InChI InChI=1S/C26H20N2O4/c29-27(30)25-13-5-11-23(19-25)9-3-1-7-21-15-17-22(18-16-21)8-2-4-10-24-12-6-14-26(20-24)28(31)32/h1-20H
InChIKey CHUHZXDXGNIIIH-UHFFFAOYSA-N
Mol Weight 424.46 g/mol
Molecular Formula C26H20N2O4
Exact Mass 424.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9tIVPt71aSn
Name 1,4-bis[4-(m-Nitrophenyl)-1,3-butadienyl]benzene
Comments Computed using HOSE algorithm
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Exact Mass 424.142307128 u
Formula C26H20N2O4
InChI InChI=1S/C26H20N2O4/c29-27(30)25-13-5-11-23(19-25)9-3-1-7-21-15-17-22(18-16-21)8-2-4-10-24-12-6-14-26(20-24)28(31)32/h1-20H
InChIKey CHUHZXDXGNIIIH-UHFFFAOYSA-N
Molecular Weight 424.456 g/mol
SMILES N(=O)(=O)C1=CC(C=CC=CC=2C=CC(C=CC=CC3=CC=CC(=C3)N(=O)=O)=CC2)=CC=C1