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METHYL-5-HYDROXY-5,6,6-TRIMETHYL-3-OXOHEPTANOATE
SpectraBase Compound ID Acxn9o3kYLs
InChI InChI=1S/C11H20O4/c1-10(2,3)11(4,14)7-8(12)6-9(13)15-5/h14H,6-7H2,1-5H3
InChIKey QGTAFXFSVKBJCC-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9S4pfDD1sPR
Name METHYL-5-HYDROXY-5,6,6-TRIMETHYL-3-OXOHEPTANOATE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-10(2,3)11(4,14)7-8(12)6-9(13)15-5/h14H,6-7H2,1-5H3
InChIKey QGTAFXFSVKBJCC-UHFFFAOYSA-N
Literature Reference Author M.G.ORGAN,R.D.J.FROESE,J.D.GODDARD,N.J.TAYLOR,G.L.LANGE
Literature Reference Citation J.AM.CHEM.SOC.,116,3312(1994)
Literature Reference DOI 10.1021/ja00087a018
Molecular Weight 216.277 g/mol
Solvent CDCl3
Source File Reference UWSI3802