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bis(2-Ethylhexyl) 3,3'-[2,2'-bipyridine]-5,5'-diylbis[(E)-prop-2-enoate]
SpectraBase Compound ID 6fRqqBNUIjH
InChI InChI=1S/C32H44N2O4/c1-5-9-11-25(7-3)23-37-31(35)19-15-27-13-17-29(33-21-27)30-18-14-28(22-34-30)16-20-32(36)38-24-26(8-4)12-10-6-2/h13-22,25-26H,5-12,23-24H2,1-4H3/b19-15+,20-16+
InChIKey HZOADYGXDQSLOR-MXWIWYRXSA-N
Mol Weight 520.7 g/mol
Molecular Formula C32H44N2O4
Exact Mass 520.330108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjrGf73s0no
Name bis(2-Ethylhexyl) 3,3'-[2,2'-bipyridine]-5,5'-diylbis[(E)-prop-2-enoate]
Comments Computed using HOSE algorithm
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Exact Mass 520.330107901 u
Formula C32H44N2O4
InChI InChI=1S/C32H44N2O4/c1-5-9-11-25(7-3)23-37-31(35)19-15-27-13-17-29(33-21-27)30-18-14-28(22-34-30)16-20-32(36)38-24-26(8-4)12-10-6-2/h13-22,25-26H,5-12,23-24H2,1-4H3/b19-15+,20-16+
InChIKey HZOADYGXDQSLOR-MXWIWYRXSA-N
Molecular Weight 520.714 g/mol
SMILES C=1(C=CC(=CN1)\C=C\C(=O)OCC(CCCC)CC)C=1C=CC(=CN1)\C=C\C(=O)OCC(CCCC)CC