John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8aai8wc2wFY SpectraBase Spectrum ID=2bs73zyuD6H

(accessed ).
(E)-3-[2,3,6-TRIHEXYL-4,5-BIS-[(E)-2-METHOXYCARBONYLVINYL]-PHENYL]-ACRILIC-ACID-METHYLESTER
SpectraBase Compound ID 8aai8wc2wFY
InChI InChI=1S/C36H54O6/c1-7-10-13-16-19-28-29(20-17-14-11-8-2)32(23-26-35(38)41-5)33(24-27-36(39)42-6)30(21-18-15-12-9-3)31(28)22-25-34(37)40-4/h22-27H,7-21H2,1-6H3/b25-22+,26-23+,27-24+
InChIKey FCFAAAAHJNUCMC-NQXXUPRISA-N
Mol Weight 582.8 g/mol
Molecular Formula C36H54O6
Exact Mass 582.39204 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bs73zyuD6H
Name (E)-3-[2,3,6-TRIHEXYL-4,5-BIS-[(E)-2-METHOXYCARBONYLVINYL]-PHENYL]-ACRILIC-ACID-METHYLESTER
Compound Number 2G
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H54O6
InChI InChI=1S/C36H54O6/c1-7-10-13-16-19-28-29(20-17-14-11-8-2)32(23-26-35(38)41-5)33(24-27-36(39)42-6)30(21-18-15-12-9-3)31(28)22-25-34(37)40-4/h22-27H,7-21H2,1-6H3/b25-22+,26-23+,27-24+
InChIKey FCFAAAAHJNUCMC-NQXXUPRISA-N
Literature Reference Author S.SAITO,T.KAWASAKI,N.TSUBOYA,Y.YAMAMOTO
Literature Reference Citation J.ORG.CHEM.,66,796(2001)
Literature Reference DOI 10.1021/jo0056242
Molecular Weight 582.821 g/mol
Solvent CDCl3
Source File Reference UWVN26139
SpectraBase Batch ID ILSUaJFvfsA