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DIMETHYL-6,6'-DIOXO-6,6'-[UNDECAN-1,11-DIYLDI-(PARA-PHENYLENE)]-DIHEXANOATE
SpectraBase Compound ID GygQrhbDerm
InChI InChI=1S/C37H52O6/c1-42-36(40)20-14-12-18-34(38)32-26-22-30(23-27-32)16-10-8-6-4-3-5-7-9-11-17-31-24-28-33(29-25-31)35(39)19-13-15-21-37(41)43-2/h22-29H,3-21H2,1-2H3
InChIKey JEDAKLSUHOCBGL-UHFFFAOYSA-N
Mol Weight 592.8 g/mol
Molecular Formula C37H52O6
Exact Mass 592.376389 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rDYYLMMo4n
Name DIMETHYL-6,6'-DIOXO-6,6'-[UNDECAN-1,11-DIYLDI-(PARA-PHENYLENE)]-DIHEXANOATE
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H52O6
InChI InChI=1S/C37H52O6/c1-42-36(40)20-14-12-18-34(38)32-26-22-30(23-27-32)16-10-8-6-4-3-5-7-9-11-17-31-24-28-33(29-25-31)35(39)19-13-15-21-37(41)43-2/h22-29H,3-21H2,1-2H3
InChIKey JEDAKLSUHOCBGL-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 592.816 g/mol
Solvent CDCl3
Source File Reference UWCS20759