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5-(ethoxymethylene)-2,2-dimethyl-1,3-dioxane-4,6-quinone
SpectraBase Compound ID LJFjJzq5Vmb
InChI InChI=1S/C9H12O5/c1-4-12-5-6-7(10)13-9(2,3)14-8(6)11/h5H,4H2,1-3H3
InChIKey VRWNGTZFEHJVFT-UHFFFAOYSA-N
Mol Weight 200.19 g/mol
Molecular Formula C9H12O5
Exact Mass 200.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4VbHJ3SRXak
Name 5-(ethoxymethylene)-2,2-dimethyl-1,3-dioxane-4,6-quinone
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O5
InChI InChI=1S/C9H12O5/c1-4-12-5-6-7(10)13-9(2,3)14-8(6)11/h5H,4H2,1-3H3
InChIKey VRWNGTZFEHJVFT-UHFFFAOYSA-N
Literature Reference Author C.HAMETNER,P.CERNUCHOVA,V.MILATA,G.VO-THANH,A.LOUPY
Literature Reference Citation MAGN.RES.CHEM.,43,171(2005)
Literature Reference DOI 10.1002/mrc.1522
Molecular Weight 200.191 g/mol
Sample ID 27552
Solvent CDCl3