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2-(2,6-Dimethyl-4-oxo-cyclohexa-2,5-dienyl)-2,1'-trimethylene-indan-1,3-dione
SpectraBase Compound ID 89YgqiKkr3y
InChI InChI=1S/C20H18O3/c1-12-10-14(21)11-13(2)19(12)8-5-9-20(19)17(22)15-6-3-4-7-16(15)18(20)23/h3-4,6-7,10-11H,5,8-9H2,1-2H3
InChIKey BUPCNJKNOVYXRL-UHFFFAOYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C20H18O3
Exact Mass 306.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71qlSkznkZJ
Name 2-(2,6-Dimethyl-4-oxo-cyclohexa-2,5-dienyl)-2,1'-trimethylene-indan-1,3-dione
CAS Registry Number 113378-85-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18O3
InChI InChI=1S/C20H18O3/c1-12-10-14(21)11-13(2)19(12)8-5-9-20(19)17(22)15-6-3-4-7-16(15)18(20)23/h3-4,6-7,10-11H,5,8-9H2,1-2H3
InChIKey BUPCNJKNOVYXRL-UHFFFAOYSA-N
Literature Reference A.S. Kende, K. Koch, C.A.Smith, J. Am. Chem. Soc. 110, 2210 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3