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1,4-Cyclohexanedione
SpectraBase Compound ID 8FvzW9jw18P
InChI InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2
InChIKey DCZFGQYXRKMVFG-UHFFFAOYSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.052429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77Cbh9kfGZF
Name CYCLOHEXAN-1,4-DION
CAS Registry Number 637-88-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2
InChIKey DCZFGQYXRKMVFG-UHFFFAOYSA-N
Literature Reference Author J.A.HIRSCH,E.HAVINGA
Literature Reference Citation J.ORG.CHEM.,41,455(1976)
Literature Reference DOI 10.1021/jo00865a008
Molecular Weight 112.128 g/mol
Solvent CDCl3
Source File Reference UNIW10845