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METHYL-(1S,3S)-3-[2-(2-CHLOROPHENYL)-ETHEN-1-YL]-2,2-DIMETHYLCYCLOPROPANE-1-CARBOXYLATE;MIXTURE

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METHYL-(1S,3S)-3-[2-(2-CHLOROPHENYL)-ETHEN-1-YL]-2,2-DIMETHYLCYCLOPROPANE-1-CARBOXYLATE;MIXTURE
SpectraBase Compound ID IfdGQNrxZZR
InChI InChI=1S/2C15H17ClO2/c2*1-15(2)11(13(15)14(17)18-3)9-8-10-6-4-5-7-12(10)16/h2*4-9,11,13H,1-3H3/b9-8+;9-8-/t2*11-,13+/m00/s1
InChIKey QVGAZIBUEQYARN-UBJZNNHBSA-N
Mol Weight 529.5 g/mol
Molecular Formula C30H34Cl2O4
Exact Mass 528.183415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3sS9eRtsrwK
Name METHYL-(1S,3S)-3-[2-(2-CHLOROPHENYL)-ETHEN-1-YL]-2,2-DIMETHYLCYCLOPROPANE-1-CARBOXYLATE;MIXTURE
Compound Number (Z)-#10A;(E)-#10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34Cl2O4
InChI InChI=1S/2C15H17ClO2/c2*1-15(2)11(13(15)14(17)18-3)9-8-10-6-4-5-7-12(10)16/h2*4-9,11,13H,1-3H3/b9-8+;9-8-/t2*11-,13+/m00/s1
InChIKey QVGAZIBUEQYARN-UBJZNNHBSA-N
Literature Reference Author E.S.D.ALVARENGA,V.M.T.CARNEIRO.G.C.RESENDE,M.C.PICANCO,E.D.S .FARIAS,M.C.LOPES
Literature Reference Citation MOLECULES,17,13989(2012)
Literature Reference DOI 10.3390/molecules171213989
Molecular Weight 529.504 g/mol
Sample ID 854
Solvent CDCl3