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1-(3-Chloro-4-methylphenyl)-4-[4-(7-chloro-4-quinolinylamino)phenyl]piperazine
SpectraBase Compound ID 6eS0aHrHiMq
InChI InChI=1S/C26H24Cl2N4/c1-18-2-6-22(17-24(18)28)32-14-12-31(13-15-32)21-7-4-20(5-8-21)30-25-10-11-29-26-16-19(27)3-9-23(25)26/h2-11,16-17H,12-15H2,1H3,(H,29,30)
InChIKey DLXFPDSQUUHWIJ-UHFFFAOYSA-N
Mol Weight 463.41 g/mol
Molecular Formula C26H24Cl2N4
Exact Mass 462.137802 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CLef9HOTvOJ
Name 1-(3-Chloro-4-methylphenyl)-4-[4-(7-chloro-4-quinolinylamino)phenyl]piperazine
Comments Computed using HOSE algorithm
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Exact Mass 462.137802189 u
Formula C26H24Cl2N4
InChI InChI=1S/C26H24Cl2N4/c1-18-2-6-22(17-24(18)28)32-14-12-31(13-15-32)21-7-4-20(5-8-21)30-25-10-11-29-26-16-19(27)3-9-23(25)26/h2-11,16-17H,12-15H2,1H3,(H,29,30)
InChIKey DLXFPDSQUUHWIJ-UHFFFAOYSA-N
Molecular Weight 463.412 g/mol
SMILES C1(Cl)=CC=C2C(=C1)N=CC=C2NC1=CC=C(C=C1)N1CCN(CC1)C1=CC=C(C(Cl)=C1)C