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N-[(E)-(2-bromophenyl)methylidene]-4-(4-chlorobenzyl)-1-piperazinamine

View entire compound with spectra: 2 NMR

N-[(E)-(2-bromophenyl)methylidene]-4-(4-chlorobenzyl)-1-piperazinamine
SpectraBase Compound ID 26oFVNZm74N
InChI InChI=1S/C18H19BrClN3/c19-18-4-2-1-3-16(18)13-21-23-11-9-22(10-12-23)14-15-5-7-17(20)8-6-15/h1-8,13H,9-12,14H2/b21-13+
InChIKey YZHZQEHFFSKHJU-FYJGNVAPSA-N
Mol Weight 392.73 g/mol
Molecular Formula C18H19BrClN3
Exact Mass 391.045088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KGJDG8FNf0f
Name N-[(E)-(2-Bromophenyl)methylidene]-4-(4-chlorobenzyl)-1-piperazinamine
Comments Computed using HOSE algorithm
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Exact Mass 391.045088324 u
Formula C18H19BrClN3
InChI InChI=1S/C18H19BrClN3/c19-18-4-2-1-3-16(18)13-21-23-11-9-22(10-12-23)14-15-5-7-17(20)8-6-15/h1-8,13H,9-12,14H2/b21-13+
InChIKey YZHZQEHFFSKHJU-FYJGNVAPSA-N
Molecular Weight 392.728 g/mol
SMILES C1=CC=C(\C=N\N2CCN(CC2)CC=2C=CC(=CC2)Cl)C(Br)=C1