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5-Acetyl-5-methyl-1,3-dioxane

View entire compound with spectra: 7 NMR, 1 FTIR, 1 Raman, and 1 MS (GC)

5-Acetyl-5-methyl-1,3-dioxane
SpectraBase Compound ID 4bNbnzVFGOG
InChI InChI=1S/C7H12O3/c1-6(8)7(2)3-9-5-10-4-7/h3-5H2,1-2H3
InChIKey UHJLFCXOYRLBEO-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jo09TH5c9S
Name 5-ACETYL-5-METHYL-1,3-DIOXANE;(CONFORMER-B)
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-6(8)7(2)3-9-5-10-4-7/h3-5H2,1-2H3
InChIKey UHJLFCXOYRLBEO-UHFFFAOYSA-N
Literature Reference Author G.W.BUCHANAN,S.H.PREUSSER,V.L.WEBB
Literature Reference Citation CAN.J.CHEM.,62,1308(1984)
Literature Reference DOI 10.1139/v84-219
Molecular Weight 144.170 g/mol
Solvent TOLUENE-D8
Source File Reference UWED2499