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4,4''-Diamino-4',4'''-bibenzanilide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

4,4''-Diamino-4',4'''-bibenzanilide
SpectraBase Compound ID DXCFsSkXcsJ
InChI InChI=1S/C26H22N4O2/c27-21-9-1-19(2-10-21)25(31)29-23-13-5-17(6-14-23)18-7-15-24(16-8-18)30-26(32)20-3-11-22(28)12-4-20/h1-16H,27-28H2,(H,29,31)(H,30,32)
InChIKey AKNRLQNAGRGLAD-UHFFFAOYSA-N
Mol Weight 422.49 g/mol
Molecular Formula C26H22N4O2
Exact Mass 422.174276 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ULYWzmod2y
Name 4,4''-Diamino-4',4'''-bibenzanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.174275962 u
Formula C26H22N4O2
InChI InChI=1S/C26H22N4O2/c27-21-9-1-19(2-10-21)25(31)29-23-13-5-17(6-14-23)18-7-15-24(16-8-18)30-26(32)20-3-11-22(28)12-4-20/h1-16H,27-28H2,(H,29,31)(H,30,32)
InChIKey AKNRLQNAGRGLAD-UHFFFAOYSA-N
Molecular Weight 422.488 g/mol
SMILES NC1=CC=C(C(=O)NC2=CC=C(C3=CC=C(C=C3)NC(C3=CC=C(C=C3)N)=O)C=C2)C=C1