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6-AMINO-2-METHYL-2,4-BIS-(4-CHLOROPHENYL)-2,3-DIHYDRO-1,5-BENZOXAZEPINE
SpectraBase Compound ID AGpGNuQI5lh
InChI InChI=1S/C22H18Cl2N2O/c1-22(15-7-11-17(24)12-8-15)13-19(14-5-9-16(23)10-6-14)26-21-18(25)3-2-4-20(21)27-22/h2-12H,13,25H2,1H3
InChIKey KJYGJCDEGQGXAY-UHFFFAOYSA-N
Mol Weight 397.31 g/mol
Molecular Formula C22H18Cl2N2O
Exact Mass 396.079619 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Z9hOZ3ZAue
Name 6-AMINO-2-METHYL-2,4-BIS-(4-CHLOROPHENYL)-2,3-DIHYDRO-1,5-BENZOXAZEPINE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H18Cl2N2O
InChI InChI=1S/C22H18Cl2N2O/c1-22(15-7-11-17(24)12-8-15)13-19(14-5-9-16(23)10-6-14)26-21-18(25)3-2-4-20(21)27-22/h2-12H,13,25H2,1H3
InChIKey KJYGJCDEGQGXAY-UHFFFAOYSA-N
Literature Reference Author C.G.NEOCHORITIS,C.A.TSOLERIDIS,J.STEPHANIDOU-STEPHANATOU,C.A .KONTOGIORGIS,D.J.HA
Literature Reference Citation J.MED.CHEM.,53,8409(2010)
Literature Reference DOI 10.1021/jm100739n
Molecular Weight 397.304 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWMZ47636