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(1R,3S)-3-allyl-1-chloro-2-keto-5-methylene-cyclohexane-1-carboxylic acid methyl ester
SpectraBase Compound ID Hm17bxDxE73
InChI InChI=1S/C12H15ClO3/c1-4-5-9-6-8(2)7-12(13,10(9)14)11(15)16-3/h4,9H,1-2,5-7H2,3H3/t9-,12+/m0/s1
InChIKey DJKYVFQBDUMLFF-JOYOIKCWSA-N
Mol Weight 242.7 g/mol
Molecular Formula C12H15ClO3
Exact Mass 242.070972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DdHr15VGvxM
Name (1R,3S)-3-allyl-1-chloro-2-keto-5-methylene-cyclohexane-1-carboxylic acid methyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15ClO3
InChI InChI=1S/C12H15ClO3/c1-4-5-9-6-8(2)7-12(13,10(9)14)11(15)16-3/h4,9H,1-2,5-7H2,3H3/t9-,12+/m0/s1
InChIKey DJKYVFQBDUMLFF-JOYOIKCWSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 242.702 g/mol
Source File Reference MHKO25320