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1-METHYL-4-{4-[[TRANS-2-(2,4-DICHLOROPHENYL)-2-[(1H-IMIDAZOL-1-YL)-METHYL]-1,3-DIOXALAN-4-YL]-METHYLENEOXY]-PHENYL}-PIPERAZINE

View entire compound with spectra: 1 NMR

1-METHYL-4-{4-[[TRANS-2-(2,4-DICHLOROPHENYL)-2-[(1H-IMIDAZOL-1-YL)-METHYL]-1,3-DIOXALAN-4-YL]-METHYLENEOXY]-PHENYL}-PIPERAZINE
SpectraBase Compound ID 4Xb14JkoYzo
InChI InChI=1S/C25H28Cl2N4O3/c1-29-10-12-31(13-11-29)20-3-5-21(6-4-20)32-15-22-16-33-25(34-22,17-30-9-8-28-18-30)23-7-2-19(26)14-24(23)27/h2-9,14,18,22H,10-13,15-17H2,1H3/t22-,25+/m0/s1
InChIKey VPEMJXGVMNRVMM-WIOPSUGQSA-N
Mol Weight 503.43 g/mol
Molecular Formula C25H28Cl2N4O3
Exact Mass 502.153846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BFWiSpK8Kp3
Name 1-METHYL-4-{4-[[TRANS-2-(2,4-DICHLOROPHENYL)-2-[(1H-IMIDAZOL-1-YL)-METHYL]-1,3-DIOXALAN-4-YL]-METHYLENEOXY]-PHENYL}-PIPERAZINE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28Cl2N4O3
InChI InChI=1S/C25H28Cl2N4O3/c1-29-10-12-31(13-11-29)20-3-5-21(6-4-20)32-15-22-16-33-25(34-22,17-30-9-8-28-18-30)23-7-2-19(26)14-24(23)27/h2-9,14,18,22H,10-13,15-17H2,1H3/t22-,25+/m0/s1
InChIKey VPEMJXGVMNRVMM-WIOPSUGQSA-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 503.428 g/mol
Solvent Unknown
Source File Reference UWCP3013