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Ethyl 6,6-dimethyl-5-oxoheptanoate
SpectraBase Compound ID HtsLyR0DaGz
InChI InChI=1S/C11H20O3/c1-5-14-10(13)8-6-7-9(12)11(2,3)4/h5-8H2,1-4H3
InChIKey RXCGRTUSZXCZBY-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C11H20O3
Exact Mass 200.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DuQUuGL1mQz
Name ETHYL-6,6-DIMETHYL-5-OXOHEPTANOATE
Compound Number 3EC
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H20O3
InChI InChI=1S/C11H20O3/c1-5-14-10(13)8-6-7-9(12)11(2,3)4/h5-8H2,1-4H3
InChIKey RXCGRTUSZXCZBY-UHFFFAOYSA-N
Literature Reference Author M.YASUDA,K.CHIBA,N.OHIGASHI,Y.KATOH,A.BABA
Literature Reference Citation J.AM.CHEM.SOC.,125,7291(2003)
Literature Reference DOI 10.1021/ja028853+
Molecular Weight 200.278 g/mol
Sample ID 41235
Solvent CDCl3