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(Z)-2-[4-[(Z)-1-cyano-2-(2,5-dioctoxyphenyl)vinyl]phenyl]-3-(2,5-dioctoxyphenyl)acrylonitrile

View entire compound with spectra: 1 NMR

(Z)-2-[4-[(Z)-1-cyano-2-(2,5-dioctoxyphenyl)vinyl]phenyl]-3-(2,5-dioctoxyphenyl)acrylonitrile
SpectraBase Compound ID AtnN0305dGi
InChI InChI=1S/C56H80N2O4/c1-5-9-13-17-21-25-37-59-53-33-35-55(61-39-27-23-19-15-11-7-3)49(43-53)41-51(45-57)47-29-31-48(32-30-47)52(46-58)42-50-44-54(60-38-26-22-18-14-10-6-2)34-36-56(50)62-40-28-24-20-16-12-8-4/h29-36,41-44H,5-28,37-40H2,1-4H3/b51-41+,52-42+
InChIKey RAGXDXDUOZAPSS-LALCGSRASA-N
Mol Weight 845.3 g/mol
Molecular Formula C56H80N2O4
Exact Mass 844.611809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ep0lqqiJWhv
Name (Z)-2-[4-[(Z)-1-cyano-2-(2,5-dioctoxyphenyl)vinyl]phenyl]-3-(2,5-dioctoxyphenyl)acrylonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H80N2O4
InChI InChI=1S/C56H80N2O4/c1-5-9-13-17-21-25-37-59-53-33-35-55(61-39-27-23-19-15-11-7-3)49(43-53)41-51(45-57)47-29-31-48(32-30-47)52(46-58)42-50-44-54(60-38-26-22-18-14-10-6-2)34-36-56(50)62-40-28-24-20-16-12-8-4/h29-36,41-44H,5-28,37-40H2,1-4H3/b51-41+,52-42+
InChIKey RAGXDXDUOZAPSS-LALCGSRASA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 845.262 g/mol
Source File Reference MHKO20023