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6-HYDROXY-2,2,4-TRIMETHYL-2,3-DIHYDRO-1-H-1,5-BENZODIAZEPINE
SpectraBase Compound ID 3uzpgScHUj0
InChI InChI=1S/C12H16N2O/c1-8-7-12(2,3)14-9-5-4-6-10(15)11(9)13-8/h4-6,14-15H,7H2,1-3H3
InChIKey WBVXBYBWNKHWRH-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C12H16N2O
Exact Mass 204.126263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 391afF5KeQl
Name 6-HYDROXY-2,2,4-TRIMETHYL-2,3-DIHYDRO-1-H-1,5-BENZODIAZEPINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N2O
InChI InChI=1S/C12H16N2O/c1-8-7-12(2,3)14-9-5-4-6-10(15)11(9)13-8/h4-6,14-15H,7H2,1-3H3
InChIKey WBVXBYBWNKHWRH-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 204.272 g/mol
Solvent CDCl3
Source File Reference UWMZ47633