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4-(2-HYDROXY-4,4-DIMETHYL-6-OXOCYCLOHEX-1-EN-1-YL)-1-METHYL-3-NITROQUINOLIN-2(1H)-ONE
SpectraBase Compound ID 8atFthEGSzt
InChI InChI=1S/C18H18N2O5/c1-18(2)8-12(21)15(13(22)9-18)14-10-6-4-5-7-11(10)19(3)17(23)16(14)20(24)25/h4-7,21H,8-9H2,1-3H3
InChIKey JHFSKTUONQECQM-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C18H18N2O5
Exact Mass 342.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BF02TttmDzq
Name 4-(2-HYDROXY-4,4-DIMETHYL-6-OXOCYCLOHEX-1-EN-1-YL)-1-METHYL-3-NITROQUINOLIN-2(1H)-ONE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18N2O5
InChI InChI=1S/C18H18N2O5/c1-18(2)8-12(21)15(13(22)9-18)14-10-6-4-5-7-11(10)19(3)17(23)16(14)20(24)25/h4-7,21H,8-9H2,1-3H3
InChIKey JHFSKTUONQECQM-UHFFFAOYSA-N
Literature Reference Author W.STADLBAUER,A.E.TAEUBL,H.V.DANG,C.REIDLINGER,K.ZANGGER
Literature Reference Citation J.HETCYCL.CHEM.,43,117(2006)
Literature Reference DOI 10.1002/jhet.5570430118
Molecular Weight 342.351 g/mol
Sample ID 66642
Solvent DMSO-D6