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(3-S*,3A-S*)-3A,7,7-TRIMETHYL-3-PHENYL-3A,4,6,7-TETRAHYDRO-3-H-INDENE-2,5-DIONE
SpectraBase Compound ID HughS5eXijx
InChI InChI=1S/C18H20O2/c1-17(2)10-13(19)11-18(3)15(17)9-14(20)16(18)12-7-5-4-6-8-12/h4-9,16H,10-11H2,1-3H3/t16-,18+/m0/s1
InChIKey YEZFGITXITYKDL-FUHWJXTLSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AVTZcpHwvjz
Name (3-S*,3A-S*)-3A,7,7-TRIMETHYL-3-PHENYL-3A,4,6,7-TETRAHYDRO-3-H-INDENE-2,5-DIONE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-17(2)10-13(19)11-18(3)15(17)9-14(20)16(18)12-7-5-4-6-8-12/h4-9,16H,10-11H2,1-3H3/t16-,18+/m0/s1
InChIKey YEZFGITXITYKDL-FUHWJXTLSA-N
Literature Reference Author A.FERNANDEZ-MATEOS,E.M.M.DELANAVA,G.P.COCA,R.R.GONZALEZ,A.I. R.SILVO,M.S.J.SIMMON
Literature Reference Citation J.ORG.CHEM.,63,9440(1998)
Literature Reference DOI 10.1021/jo981456q
Molecular Weight 268.356 g/mol
Sample ID 26909
Solvent CDCl3