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TWFJMNZBFSTTNG-HYXAFXHYSA-N
SpectraBase Compound ID IUI8xs5MdrA
InChI InChI=1S/C8H12O/c1-2-4-6-8-7(9-8)5-3-1/h3,5,7-8H,1-2,4,6H2/b5-3-
InChIKey TWFJMNZBFSTTNG-HYXAFXHYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DzHtCqlzPd9
Name TWFJMNZBFSTTNG-HYXAFXHYSA-N
Compound Number 6/6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-2-4-6-8-7(9-8)5-3-1/h3,5,7-8H,1-2,4,6H2/b5-3-
InChIKey TWFJMNZBFSTTNG-HYXAFXHYSA-N
Literature Reference Author D.R.PAULSON,F.Y.N.TANG,G.F.MORAN,A.S.MURRAY,B.P.PELKA,E.M.VA SQUEZ
Literature Reference Citation J.ORG.CHEM.,40,184(1975)
Literature Reference DOI 10.1021/jo00890a007
Molecular Weight 124.183 g/mol
Solvent CDCl3
Source File Reference UWCS9940