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3,3-Dimethyl-cyclohexanone
SpectraBase Compound ID EZUh2pjObhn
InChI InChI=1S/C8H14O/c1-8(2)5-3-4-7(9)6-8/h3-6H2,1-2H3
InChIKey ZVJQBBYAVPAFLX-UHFFFAOYSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EhuGtA8EBBO
Name 3,3-DIMETHYL-CYCLOHEXANONE
CAS Registry Number 2979-19-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-8(2)5-3-4-7(9)6-8/h3-6H2,1-2H3
InChIKey ZVJQBBYAVPAFLX-UHFFFAOYSA-N
Literature Reference Author J.K.CRANDALL,M.A.CENTENO,S.BORRESEN
Literature Reference Citation J.ORG.CHEM.,44,1184(1979)
Literature Reference DOI 10.1021/jo01321a043
Solvent DIOXANE
Source File Reference UNIO723