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6-HYDROXY-2-METHYL-2,4-BIS-(4-CHLOROPHENYL)-2,3-DIHYDRO-1-H-1,5-BENZODIAZEPINE
SpectraBase Compound ID 9kfPdZS7vOk
InChI InChI=1S/C22H18Cl2N2O/c1-22(15-7-11-17(24)12-8-15)13-19(14-5-9-16(23)10-6-14)25-21-18(26-22)3-2-4-20(21)27/h2-12,26-27H,13H2,1H3
InChIKey IJAFILGOJKBYDH-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 JlXj3bEjbLI
Name 6-HYDROXY-2-METHYL-2,4-BIS-(4-CHLOROPHENYL)-2,3-DIHYDRO-1-H-1,5-BENZODIAZEPINE
Compound Number 6F
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)25-21-18(26-22)3-2-4-20(21)27/h2-12,26-27H,13H2,1H3
InChIKey IJAFILGOJKBYDH-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
Source File Reference UWMZ47644