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(3E,5E)-1,1-Dicyano-6-[3-chloro-5-[(1E,3E,5E)-6-(p-octyloxyphenyl)-hexa-1,3,5-trienyl]pyrazin-2-yl]-hexa-1,3,5-triene
SpectraBase Compound ID IX7pnoH5aS1
InChI InChI=1S/C32H33ClN4O/c1-2-3-4-5-8-14-23-38-30-21-19-27(20-22-30)15-10-6-7-12-17-29-26-36-31(32(33)37-29)18-13-9-11-16-28(24-34)25-35/h6-7,9-13,15-22,26H,2-5,8,14,23H2,1H3/b7-6+,11-9+,15-10+,17-12+,18-13+
InChIKey IHQNDWOKJBOSPU-ZEMFTOTBSA-N
Mol Weight 525.1 g/mol
Molecular Formula C32H33ClN4O
Exact Mass 524.234289 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9br4hS7Bv40
Name (3E,5E)-1,1-Dicyano-6-[3-chloro-5-[(1E,3E,5E)-6-(p-octyloxyphenyl)-hexa-1,3,5-trienyl]pyrazin-2-yl]-hexa-1,3,5-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H33ClN4O
InChI InChI=1S/C32H33ClN4O/c1-2-3-4-5-8-14-23-38-30-21-19-27(20-22-30)15-10-6-7-12-17-29-26-36-31(32(33)37-29)18-13-9-11-16-28(24-34)25-35/h6-7,9-13,15-22,26H,2-5,8,14,23H2,1H3/b7-6+,11-9+,15-10+,17-12+,18-13+
InChIKey IHQNDWOKJBOSPU-ZEMFTOTBSA-N
Molecular Weight 525.096 g/mol
SMILES c1(nc(cnc1\C=C\C=C\C=C(C#N)C#N)\C=C\C=C\C=C\c1ccc(OCCCCCCCC)cc1)Cl
SPLASH splash10-0a4i-5902110000-a408fda0c49a329bab5f
Source of Spectrum F-67-2295-12b
Wiley ID 1686052