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4-tert-butyl-6-keto-cyclohexene-1-carboxylic acid ethyl ester

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4-tert-butyl-6-keto-cyclohexene-1-carboxylic acid ethyl ester
SpectraBase Compound ID 3TpmAiNE0XF
InChI InChI=1S/C13H20O3/c1-5-16-12(15)10-7-6-9(8-11(10)14)13(2,3)4/h7,9H,5-6,8H2,1-4H3
InChIKey QKMOKAFVQGHVQK-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNjCOBCxwfZ
Name 4-tert-butyl-6-keto-cyclohexene-1-carboxylic acid ethyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-16-12(15)10-7-6-9(8-11(10)14)13(2,3)4/h7,9H,5-6,8H2,1-4H3
InChIKey QKMOKAFVQGHVQK-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 224.300 g/mol
Source File Reference MHKO13277