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5,5-DIMETHOXY-1-AZABICYCLO-[2.2.2]-OCTANE-3-CARBOXYLIC-ACID-HEPTYLESTER;ENDO-ISOMER
SpectraBase Compound ID EEXnI6MwT1n
InChI InChI=1S/C17H31NO4/c1-4-5-6-7-8-11-22-16(19)14-12-18-10-9-15(14)17(13-18,20-2)21-3/h14-15H,4-13H2,1-3H3/t14-,15+/m0/s1
InChIKey YOVFQZPAFJABDE-LSDHHAIUSA-N
Mol Weight 313.44 g/mol
Molecular Formula C17H31NO4
Exact Mass 313.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJm5A6LgahJ
Name 5,5-DIMETHOXY-1-AZABICYCLO-[2.2.2]-OCTANE-3-CARBOXYLIC-ACID-HEPTYLESTER;ENDO-ISOMER
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H31NO4
InChI InChI=1S/C17H31NO4/c1-4-5-6-7-8-11-22-16(19)14-12-18-10-9-15(14)17(13-18,20-2)21-3/h14-15H,4-13H2,1-3H3/t14-,15+/m0/s1
InChIKey YOVFQZPAFJABDE-LSDHHAIUSA-N
Literature Reference Author C.K.M.CLURE,A.J.KIESSLING,J.S.LINK
Literature Reference Citation ORG.LETTERS,5,3811(2003)
Literature Reference DOI 10.1021/ol035202p
Molecular Weight 313.437 g/mol
Sample ID 33997
Solvent CDCl3