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N,N'-bis(p-nitrobenzylidene)-p-phenylenediamine

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 2 UV-Vis

N,N'-bis(p-nitrobenzylidene)-p-phenylenediamine
SpectraBase Compound ID 5TKaQqt4hBt
InChI InChI=1S/C20H14N4O4/c25-23(26)19-9-1-15(2-10-19)13-21-17-5-7-18(8-6-17)22-14-16-3-11-20(12-4-16)24(27)28/h1-14H/b21-13+,22-14+
InChIKey NFIJRJJFEMDZJR-JFMUQQRKSA-N
Mol Weight 374.36 g/mol
Molecular Formula C20H14N4O4
Exact Mass 374.101505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B92nxop7KxH
Name N,N'-bis(p-Nitrobenzylidene)-p-phenylenediamine
Comments Computed using HOSE algorithm
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Exact Mass 374.101504943 u
Formula C20H14N4O4
InChI InChI=1S/C20H14N4O4/c25-23(26)19-9-1-15(2-10-19)13-21-17-5-7-18(8-6-17)22-14-16-3-11-20(12-4-16)24(27)28/h1-14H/b21-13+,22-14+
InChIKey NFIJRJJFEMDZJR-JFMUQQRKSA-N
Molecular Weight 374.356 g/mol
SMILES N(=O)(=O)C=1C=CC(\C=N\C=2C=CC(\N=C\C=3C=CC(=CC3)N(=O)=O)=CC2)=CC1