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2-METHYL-7H-DIBENZ-[F,IJ]-ISOQUINOLIN-7-ONE
SpectraBase Compound ID JDNCeC3E8l6
InChI InChI=1S/C17H11NO/c1-10-9-14-11-5-2-3-6-12(11)17(19)13-7-4-8-15(18-10)16(13)14/h2-9H,1H3
InChIKey PWVPMWHZFKAUMG-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C17H11NO
Exact Mass 245.084064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BpjTCUUCJn
Name 2-METHYL-7H-DIBENZ-[F,IJ]-ISOQUINOLIN-7-ONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H11NO
InChI InChI=1S/C17H11NO/c1-10-9-14-11-5-2-3-6-12(11)17(19)13-7-4-8-15(18-10)16(13)14/h2-9H,1H3
InChIKey PWVPMWHZFKAUMG-UHFFFAOYSA-N
Literature Reference Author X.BU,L.W.DEADY,G.J.FINLAY,B.C.BAGULEY,W.A.DENNY
Literature Reference Citation J.MED.CHEM.,44,2004(2001)
Literature Reference DOI 10.1021/jm010041l
Molecular Weight 245.280 g/mol
Sample ID 44541
Solvent CDCl3