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(1S,2R,4R)-2-(2,2-dichlorovinyl)-4-(4-ethoxyphenyl)-4-hydroxy-6-keto-cyclohexane-1-carboxylic acid ethyl ester
SpectraBase Compound ID KQKggmQ4Ms2
InChI InChI=1S/C19H22Cl2O5/c1-3-25-14-7-5-13(6-8-14)19(24)10-12(9-16(20)21)17(15(22)11-19)18(23)26-4-2/h5-9,12,17,24H,3-4,10-11H2,1-2H3/t12-,17+,19-/m1/s1
InChIKey YRFLDPIXSSFDFY-JLBUNGTFSA-N
Mol Weight 401.29 g/mol
Molecular Formula C19H22Cl2O5
Exact Mass 400.084429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IK2r47H18XE
Name (1S,2R,4R)-2-(2,2-dichlorovinyl)-4-(4-ethoxyphenyl)-4-hydroxy-6-keto-cyclohexane-1-carboxylic acid ethyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22Cl2O5
InChI InChI=1S/C19H22Cl2O5/c1-3-25-14-7-5-13(6-8-14)19(24)10-12(9-16(20)21)17(15(22)11-19)18(23)26-4-2/h5-9,12,17,24H,3-4,10-11H2,1-2H3/t12-,17+,19-/m1/s1
InChIKey YRFLDPIXSSFDFY-JLBUNGTFSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 401.287 g/mol
Source File Reference MHKO25379