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ETHYL-5,5-DIMETHYL-6-OXO-OCTANOATE

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ETHYL-5,5-DIMETHYL-6-OXO-OCTANOATE
SpectraBase Compound ID A8zJmizJM99
InChI InChI=1S/C12H22O3/c1-5-10(13)12(3,4)9-7-8-11(14)15-6-2/h5-9H2,1-4H3
InChIKey KEHROMSAMDVTTR-UHFFFAOYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RnzUB0JOpI
Name ETHYL-5,5-DIMETHYL-6-OXO-OCTANOATE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-5-10(13)12(3,4)9-7-8-11(14)15-6-2/h5-9H2,1-4H3
InChIKey KEHROMSAMDVTTR-UHFFFAOYSA-N
Literature Reference Author T.K.HUTTON,K.MUIR,D.J.PROCTER
Literature Reference Citation ORG.LETTERS,4,2345(2002)
Literature Reference DOI 10.1021/ol0260472
Molecular Weight 214.305 g/mol
Solvent CDCl3
Source File Reference UWMZ25315