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5,5-DIMETHYL-2-(PARA-NITROACETOPHENYL)-CYCLOHEXA-1,3-DIONE
SpectraBase Compound ID LXlKyYcj3iF
InChI InChI=1S/C16H17NO5/c1-16(2)8-14(19)12(15(20)9-16)7-13(18)10-3-5-11(6-4-10)17(21)22/h3-6,19H,7-9H2,1-2H3
InChIKey MWVRLHQUSIDPGM-UHFFFAOYSA-N
Mol Weight 303.31 g/mol
Molecular Formula C16H17NO5
Exact Mass 303.110673 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IwDgU1QMSqi
Name 5,5-DIMETHYL-2-(PARA-NITROACETOPHENYL)-CYCLOHEXA-1,3-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17NO5
InChI InChI=1S/C16H17NO5/c1-16(2)8-14(19)12(15(20)9-16)7-13(18)10-3-5-11(6-4-10)17(21)22/h3-6,19H,7-9H2,1-2H3
InChIKey MWVRLHQUSIDPGM-UHFFFAOYSA-N
Literature Reference Author M.P.SAMMES,P.N.MAINI
Literature Reference Citation MAGN.RES.CHEM.,25,372(1987)
Literature Reference DOI 10.1002/mrc.1260250422
Molecular Weight 303.315 g/mol
Solvent DMSO-D6
Source File Reference UNIW22077