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1-(p-aminophenyl)-4-{p-{{2-(2,4-dichlorophenyl)-2-[(imidazol-1-yl)methyl]-1,3-dioxolan-4-yl}methoxy}phenyl}piperazine
SpectraBase Compound ID 9av8X2INcxJ
InChI InChI=1S/C30H31Cl2N5O3/c31-22-1-10-28(29(32)17-22)30(20-35-12-11-34-21-35)39-19-27(40-30)18-38-26-8-6-25(7-9-26)37-15-13-36(14-16-37)24-4-2-23(33)3-5-24/h1-12,17,21,27H,13-16,18-20,33H2/t27-,30-/s2
InChIKey XYPSJKPZCXEKKA-SLHMGVEVSA-N
Mol Weight 580.52 g/mol
Molecular Formula C30H31Cl2N5O3
Exact Mass 579.180395 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FntFd6I4XZe
Name 1-(p-aminophenyl)-4-{p-{{2-(2,4-dichlorophenyl)-2-[(imidazol-1-yl)methyl]-1,3-dioxolan-4-yl}methoxy}phenyl}piperazine
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Formula C30H31Cl2N5O3
InChI InChI=1S/C30H31Cl2N5O3/c31-22-1-10-28(29(32)17-22)30(20-35-12-11-34-21-35)39-19-27(40-30)18-38-26-8-6-25(7-9-26)37-15-13-36(14-16-37)24-4-2-23(33)3-5-24/h1-12,17,21,27H,13-16,18-20,33H2/t27-,30-/s2
InChIKey XYPSJKPZCXEKKA-SLHMGVEVSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 44887M
Solvent CDCl3