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4-{4-[[TRANS-2-(2,4-DICHLOROPHENYL)-2-[(1H-IMIDAZOL-1-YL)-METHYL]-1,3-DIOXALAN-4-YL]-METHYLENEOXY]-PHENYL}-PIPERAZINE
SpectraBase Compound ID JHO7rZuMh0
InChI InChI=1S/C24H26Cl2N4O3/c25-18-1-6-22(23(26)13-18)24(16-29-10-7-28-17-29)32-15-21(33-24)14-31-20-4-2-19(3-5-20)30-11-8-27-9-12-30/h1-7,10,13,17,21,27H,8-9,11-12,14-16H2/t21-,24+/m0/s1
InChIKey LOUXSEJZCPKWAX-XUZZJYLKSA-N
Mol Weight 489.4 g/mol
Molecular Formula C24H26Cl2N4O3
Exact Mass 488.138196 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KEp6j2RgsWp
Name 4-{4-[[TRANS-2-(2,4-DICHLOROPHENYL)-2-[(1H-IMIDAZOL-1-YL)-METHYL]-1,3-DIOXALAN-4-YL]-METHYLENEOXY]-PHENYL}-PIPERAZINE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26Cl2N4O3
InChI InChI=1S/C24H26Cl2N4O3/c25-18-1-6-22(23(26)13-18)24(16-29-10-7-28-17-29)32-15-21(33-24)14-31-20-4-2-19(3-5-20)30-11-8-27-9-12-30/h1-7,10,13,17,21,27H,8-9,11-12,14-16H2/t21-,24+/m0/s1
InChIKey LOUXSEJZCPKWAX-XUZZJYLKSA-N
Literature Reference Author D.R.CHAPMAN,L.BAUER,D.P.WALLER,L.J.D.ZANEVELD
Literature Reference Citation J.HETCYCL.CHEM.,27,2063(1990)
Literature Reference DOI 10.1002/jhet.5570270739
Molecular Weight 489.401 g/mol
Solvent Unknown
Source File Reference UWCP3011