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2-BENZYL-2-(2'-OXO)-PROPYL-5,5-DIMETHYL-CYCLOHEXA-1,3-DIONE
SpectraBase Compound ID JUjaNV2W4tH
InChI InChI=1S/C18H22O3/c1-13(19)9-18(10-14-7-5-4-6-8-14)15(20)11-17(2,3)12-16(18)21/h4-8H,9-12H2,1-3H3
InChIKey ISTBTEUNYHFWCZ-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CMTbf43FqDk
Name 2-BENZYL-2-(2'-OXO)-PROPYL-5,5-DIMETHYL-CYCLOHEXA-1,3-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-13(19)9-18(10-14-7-5-4-6-8-14)15(20)11-17(2,3)12-16(18)21/h4-8H,9-12H2,1-3H3
InChIKey ISTBTEUNYHFWCZ-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 286.371 g/mol
Solvent CDCl3
Source File Reference UNIW22091