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2-[(E)-2-[4-[(E)-2-(2,5-dicyanophenyl)ethenyl]-2,5-dihexoxy-phenyl]ethenyl]benzene-1,4-dicarbonitrile
SpectraBase Compound ID 8VP1hjwSkNj
InChI InChI=1S/C38H38N4O2/c1-3-5-7-9-19-43-37-23-34(18-16-32-22-30(26-40)12-14-36(32)28-42)38(44-20-10-8-6-4-2)24-33(37)17-15-31-21-29(25-39)11-13-35(31)27-41/h11-18,21-24H,3-10,19-20H2,1-2H3/b17-15+,18-16+
InChIKey XRFQPYMZYRUKPC-YTEMWHBBSA-N
Mol Weight 582.7 g/mol
Molecular Formula C38H38N4O2
Exact Mass 582.299476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BEOGi67RfPK
Name 2-[(E)-2-[4-[(E)-2-(2,5-dicyanophenyl)ethenyl]-2,5-dihexoxy-phenyl]ethenyl]benzene-1,4-dicarbonitrile
Alternate Name(s) 2-[(E)-2-[4-[(E)-2-(2,5-dicyanophenyl)vinyl]-2,5-dihexoxy-phenyl]vinyl]terephthalonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H38N4O2
InChI InChI=1S/C38H38N4O2/c1-3-5-7-9-19-43-37-23-34(18-16-32-22-30(26-40)12-14-36(32)28-42)38(44-20-10-8-6-4-2)24-33(37)17-15-31-21-29(25-39)11-13-35(31)27-41/h11-18,21-24H,3-10,19-20H2,1-2H3/b17-15+,18-16+
InChIKey XRFQPYMZYRUKPC-YTEMWHBBSA-N
Molecular Weight 582.748 g/mol
SMILES c1(\C=C\c2c(cc(\C=C\c3c(C#N)ccc(C#N)c3)c(c2)OCCCCCC)OCCCCCC)c(C#N)ccc(C#N)c1
SPLASH splash10-03e9-0010950000-6686c82845ca052f97c2
Source of Spectrum K1-2001-300-1
Wiley ID 846576