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DIMETHYL-3-[(1'-(4''-CHLOROPYRID-2''-YL)-ETHENYL]-3-METHYLCYCLOHEX-4-ENE-1,2-DICARBOXYLATE
SpectraBase Compound ID hc6pu7pLd6
InChI InChI=1S/C18H20ClNO4/c1-11(14-10-12(19)7-9-20-14)18(2)8-5-6-13(16(21)23-3)15(18)17(22)24-4/h5,7-10,13,15H,1,6H2,2-4H3/t13-,15-,18?/m1/s1
InChIKey VGCITDDZWIRCPC-BUEHYOHHSA-N
Mol Weight 349.81 g/mol
Molecular Formula C18H20ClNO4
Exact Mass 349.108086 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7nmD1k98KBq
Name DIMETHYL-3-[(1'-(4''-CHLOROPYRID-2''-YL)-ETHENYL]-3-METHYLCYCLOHEX-4-ENE-1,2-DICARBOXYLATE
Compound Number 8G-4-CL -PY
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20ClNO4
InChI InChI=1S/C18H20ClNO4/c1-11(14-10-12(19)7-9-20-14)18(2)8-5-6-13(16(21)23-3)15(18)17(22)24-4/h5,7-10,13,15H,1,6H2,2-4H3/t13-,15-,18?/m1/s1
InChIKey VGCITDDZWIRCPC-BUEHYOHHSA-N
Literature Reference Author M.KNOKE,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,2259(2005)
Molecular Weight 349.814 g/mol
Sample ID 39304
Solvent CDCl3