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N,N-Dibenzyl-p-[(p-nitrophenyl)azo]benzamide
SpectraBase Compound ID IIWCSL4NEGK
InChI InChI=1S/C27H22N4O3/c32-27(30(19-21-7-3-1-4-8-21)20-22-9-5-2-6-10-22)23-11-13-24(14-12-23)28-29-25-15-17-26(18-16-25)31(33)34/h1-18H,19-20H2/b29-28+
InChIKey PMGYPHYMXOCIFP-ZQHSETAFSA-N
Mol Weight 450.5 g/mol
Molecular Formula C27H22N4O3
Exact Mass 450.169191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9FCGF41e2ks
Name N,N-Dibenzyl-p-[(p-nitrophenyl)azo]benzamide
Comments Computed using HOSE algorithm
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Exact Mass 450.169190581 u
Formula C27H22N4O3
InChI InChI=1S/C27H22N4O3/c32-27(30(19-21-7-3-1-4-8-21)20-22-9-5-2-6-10-22)23-11-13-24(14-12-23)28-29-25-15-17-26(18-16-25)31(33)34/h1-18H,19-20H2/b29-28+
InChIKey PMGYPHYMXOCIFP-ZQHSETAFSA-N
Molecular Weight 450.498 g/mol
SMILES N(=O)(=O)C1=CC=C(C=C1)\N=N\C=1C=CC(=CC1)C(=O)N(CC=1C=CC=CC1)CC=1C=CC=CC1