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4,4'-DIOXO-4,4'-[NONAN-1,9-DIYLDI-(PARA-PHENYLENE)]-DIBUTANOATE
SpectraBase Compound ID 6XKTA7WQogw
InChI InChI=1S/C31H40O6/c1-36-30(34)22-20-28(32)26-16-12-24(13-17-26)10-8-6-4-3-5-7-9-11-25-14-18-27(19-15-25)29(33)21-23-31(35)37-2/h12-19H,3-11,20-23H2,1-2H3
InChIKey WZPIWYKNZBGSKE-UHFFFAOYSA-N
Mol Weight 508.7 g/mol
Molecular Formula C31H40O6
Exact Mass 508.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I38uB4Vh1qA
Name 4,4'-DIOXO-4,4'-[NONAN-1,9-DIYLDI-(PARA-PHENYLENE)]-DIBUTANOATE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40O6
InChI InChI=1S/C31H40O6/c1-36-30(34)22-20-28(32)26-16-12-24(13-17-26)10-8-6-4-3-5-7-9-11-25-14-18-27(19-15-25)29(33)21-23-31(35)37-2/h12-19H,3-11,20-23H2,1-2H3
InChIKey WZPIWYKNZBGSKE-UHFFFAOYSA-N
Literature Reference Author M.MASCAL,J.L.KERDELHUE,A.S.BATSANOV,M.J.BEGLEY
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1141(1996)
Literature Reference DOI 10.1039/p19960001141
Molecular Weight 508.655 g/mol
Solvent CDCl3
Source File Reference UWCS20758