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Propanedinitrile, 2-[2,6-bis(3-ethyl-2(3H)-benzothiazolylidene)cyclohexylidene]-
SpectraBase Compound ID 7fPqKZBiXmS
InChI InChI=1S/C27H24N4S2/c1-3-30-21-12-5-7-14-23(21)32-26(30)19-10-9-11-20(25(19)18(16-28)17-29)27-31(4-2)22-13-6-8-15-24(22)33-27/h5-8,12-15H,3-4,9-11H2,1-2H3/b26-19-,27-20+
InChIKey VOOZALUSCQQRLF-XWFQURHXSA-N
Mol Weight 468.64 g/mol
Molecular Formula C27H24N4S2
Exact Mass 468.144239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gyfEHZv7CL
Name Propanedinitrile, 2-[2,6-bis(3-ethyl-2(3H)-benzothiazolylidene)cyclohexylidene]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N4S2
InChI InChI=1S/C27H24N4S2/c1-3-30-21-12-5-7-14-23(21)32-26(30)19-10-9-11-20(25(19)18(16-28)17-29)27-31(4-2)22-13-6-8-15-24(22)33-27/h5-8,12-15H,3-4,9-11H2,1-2H3/b26-19-,27-20+
InChIKey VOOZALUSCQQRLF-XWFQURHXSA-N
Molecular Weight 468.637 g/mol
SMILES CCN1\C(Sc2ccccc12)=C/1CCC\C(=C/2Sc3ccccc3N2CC)C1=C(C#N)C#N
SPLASH splash10-014r-1356900000-41aeaf156341013318e9
Source of Spectrum JX-2015-4-764
Synonyms 2-(2,6-bis(3-ethylbenzo[d]thiazol-2(3H)-ylidene)cyclohexylidene)malononitrile 2-[2,6-bis(3-ethyl-1,3-benzothiazol-2-ylidene)cyclohexylidene]propanedinitrile
Wiley ID 1726184