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4-(4-chlorobenzyl)-N-[(E)-(2-methoxyphenyl)methylidene]-1-piperazinamine
SpectraBase Compound ID 4y43Rhwcw8x
InChI InChI=1S/C19H22ClN3O/c1-24-19-5-3-2-4-17(19)14-21-23-12-10-22(11-13-23)15-16-6-8-18(20)9-7-16/h2-9,14H,10-13,15H2,1H3/b21-14+
InChIKey CKLUDUQRUWCLEL-KGENOOAVSA-N
Mol Weight 343.86 g/mol
Molecular Formula C19H22ClN3O
Exact Mass 343.14514 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8qbverc9XzZ
Name 4-(4-Chlorobenzyl)-N-[(E)-(2-methoxyphenyl)methylidene]-1-piperazinamine
Comments Computed using HOSE algorithm
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Exact Mass 343.145140039 u
Formula C19H22ClN3O
InChI InChI=1S/C19H22ClN3O/c1-24-19-5-3-2-4-17(19)14-21-23-12-10-22(11-13-23)15-16-6-8-18(20)9-7-16/h2-9,14H,10-13,15H2,1H3/b21-14+
InChIKey CKLUDUQRUWCLEL-KGENOOAVSA-N
Molecular Weight 343.858 g/mol
SMILES C1=CC=C(\C=N\N2CCN(CC2)CC2=CC=C(C=C2)Cl)C(OC)=C1