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ETHYL-3-HYDROXY-3-METHYL-5-OXO-2-PROPYLCYCLOPENT-1-ENECARBOXYLATE;MINOR-ISOMER
SpectraBase Compound ID FFe0KPNCYjE
InChI InChI=1S/C12H18O4/c1-4-6-8-10(11(14)16-5-2)9(13)7-12(8,3)15/h15H,4-7H2,1-3H3
InChIKey VZKYZWJQMAXQRO-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkvMYnmnGRN
Name ETHYL-3-HYDROXY-3-METHYL-2-PROPYLCYCLOPENT-1-ENE-1-CARBOXYLATE;MAJOR-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-4-6-8-10(11(14)16-5-2)9(13)7-12(8,3)15/h15H,4-7H2,1-3H3
InChIKey VZKYZWJQMAXQRO-UHFFFAOYSA-N
Literature Reference Author E.HOLTZ,V.KOEHLER,B.APPEL,P.LANGER
Literature Reference Citation EUR.J.ORG.CHEM.,532(2005)
Molecular Weight 226.273 g/mol
Sample ID 38927
Solvent CDCl3