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CHAMPANONE_A;2,2,4,4-TETRAMETHYL-6-(1-OXO-3-PHENYL-2-(E)-ENYL)-CYCLOHEXANE-1,3,5-TRIONE
SpectraBase Compound ID 5EZPVQf1N13
InChI InChI=1S/C19H20O4/c1-18(2)15(21)14(16(22)19(3,4)17(18)23)13(20)11-10-12-8-6-5-7-9-12/h5-11,20H,1-4H3/b11-10+
InChIKey JICCGTOBCJJQOJ-ZHACJKMWSA-N
Mol Weight 312.37 g/mol
Molecular Formula C19H20O4
Exact Mass 312.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3EqNDJmp3Dn
Name CHAMPANONE_A;2,2,4,4-TETRAMETHYL-6-(1-OXO-3-PHENYL-2-(E)-ENYL)-CYCLOHEXANE-1,3,5-TRIONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20O4
InChI InChI=1S/C19H20O4/c1-18(2)15(21)14(16(22)19(3,4)17(18)23)13(20)11-10-12-8-6-5-7-9-12/h5-11,20H,1-4H3/b11-10+
InChIKey JICCGTOBCJJQOJ-ZHACJKMWSA-N
Literature Reference Author A.BONILLA,C.DUQUE,C.GARZON,Y.TAKAISHI,K.YAMAGUCHI,N.HARA,Y.F UJIMOTO
Literature Reference Citation PHYTOCHEM.,66,1736(2005)
Literature Reference DOI 10.1016/j.phytochem.2005.05.025
Molecular Weight 312.365 g/mol
Sample ID 26589
Solvent CDCl3