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1,4-benzenediamine, N~1~-[(E)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-N~4~,N~4~-dimethyl-
SpectraBase Compound ID 6RfcYgfQYuS
InChI InChI=1S/C22H20Cl2N2O/c1-26(2)20-9-7-19(8-10-20)25-14-16-3-11-21(12-4-16)27-15-17-5-6-18(23)13-22(17)24/h3-14H,15H2,1-2H3/b25-14+
InChIKey APDMGTUKOKEXEY-AFUMVMLFSA-N
Mol Weight 399.32 g/mol
Molecular Formula C22H20Cl2N2O
Exact Mass 398.095269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lv3p3mEfv3
Name 1,4-Benzenediamine, N~1~-[(E)-[4-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-N~4~,N~4~-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.095268671 u
Formula C22H20Cl2N2O
InChI InChI=1S/C22H20Cl2N2O/c1-26(2)20-9-7-19(8-10-20)25-14-16-3-11-21(12-4-16)27-15-17-5-6-18(23)13-22(17)24/h3-14H,15H2,1-2H3/b25-14+
InChIKey APDMGTUKOKEXEY-AFUMVMLFSA-N
Molecular Weight 399.321 g/mol
SMILES C=1(C(COC2=CC=C(\C=N\C3=CC=C(C=C3)N(C)C)C=C2)=CC=C(C1)Cl)Cl