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(3E,5E)-1,1-Dicyano-6-[3'-chloro-5'-(julolidin-1-ylethynyl)pyrazin-2'-yl]-hexa-1,3,5-triene
SpectraBase Compound ID DMcgGI5TVB5
InChI InChI=1S/C26H20ClN5/c27-26-24(10-3-1-2-6-19(16-28)17-29)30-18-22(31-26)12-11-20-13-15-32-14-5-8-21-7-4-9-23(20)25(21)32/h1-4,6-7,9-10,18,20H,5,8,13-15H2/b2-1+,10-3+
InChIKey FAEDWJMBALVAQW-XZMAOYBGSA-N
Mol Weight 437.93 g/mol
Molecular Formula C26H20ClN5
Exact Mass 437.140723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbQorJmgWit
Name (3E,5E)-1,1-Dicyano-6-[3'-chloro-5'-(julolidin-1-ylethynyl)pyrazin-2'-yl]-hexa-1,3,5-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H20ClN5
InChI InChI=1S/C26H20ClN5/c27-26-24(10-3-1-2-6-19(16-28)17-29)30-18-22(31-26)12-11-20-13-15-32-14-5-8-21-7-4-9-23(20)25(21)32/h1-4,6-7,9-10,18,20H,5,8,13-15H2/b2-1+,10-3+
InChIKey FAEDWJMBALVAQW-XZMAOYBGSA-N
Molecular Weight 437.934 g/mol
SMILES c12N3CCC(C#Cc4nc(Cl)c(nc4)\C=C\C=C\C=C(C#N)C#N)c1cccc2CCC3
SPLASH splash10-00l2-9844000000-21e71dccc9f780d7b978
Source of Spectrum F-67-2295-8
Wiley ID 1686056