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3-[2-(4-methoxyphenyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-ylidene]-6-methyl-pyran-2,4-quinone
SpectraBase Compound ID IS4XI3NrbwI
InChI InChI=1S/C22H20N2O4/c1-13-11-20(25)21(22(26)28-13)19-12-18(14-7-9-15(27-2)10-8-14)23-16-5-3-4-6-17(16)24-19/h3-11,18,23-24H,12H2,1-2H3/b21-19+
InChIKey MBERRJCQOBJODS-XUTLUUPISA-N
Mol Weight 376.41 g/mol
Molecular Formula C22H20N2O4
Exact Mass 376.142307 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FTSfU9BSZYw
Name 3-[2-(4-methoxyphenyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-ylidene]-6-methyl-pyran-2,4-quinone
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20N2O4
InChI InChI=1S/C22H20N2O4/c1-13-11-20(25)21(22(26)28-13)19-12-18(14-7-9-15(27-2)10-8-14)23-16-5-3-4-6-17(16)24-19/h3-11,18,23-24H,12H2,1-2H3/b21-19+
InChIKey MBERRJCQOBJODS-XUTLUUPISA-N
Literature Reference Author E.M.TJIOU,E.G.LHOUSSAINE,D.VIRIEUX,A.FRUCHIER
Literature Reference Citation MAGN.RES.CHEM.,43,557(2005)
Literature Reference DOI 10.1002/mrc.1593
Solvent CDCl3
Source File Reference UWLU36056