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4,4'-Bis(4-n-hexylphenylamino)-5,5'-bis(4-n-hexylphenylimino)-2,5,2',5'-tetrahydro-1H,1'H-2,2'-ethane-1,2-diylidenebisimidazole

View entire compound with spectra: 1 MS (GC)

4,4'-Bis(4-n-hexylphenylamino)-5,5'-bis(4-n-hexylphenylimino)-2,5,2',5'-tetrahydro-1H,1'H-2,2'-ethane-1,2-diylidenebisimidazole
SpectraBase Compound ID HSRiO60Pbn3
InChI InChI=1S/C56H74N8/c1-5-9-13-17-21-43-25-33-47(34-26-43)57-53-54(58-48-35-27-44(28-36-48)22-18-14-10-6-2)62-51(61-53)41-42-52-63-55(59-49-37-29-45(30-38-49)23-19-15-11-7-3)56(64-52)60-50-39-31-46(32-40-50)24-20-16-12-8-4/h25-42H,5-24H2,1-4H3,(H,57,61)(H,58,62)(H,59,63)(H,60,64)
InChIKey BQEXVUVDVMSQHD-UHFFFAOYSA-N
Mol Weight 859.3 g/mol
Molecular Formula C56H74N8
Exact Mass 858.603644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ay69NyJ6Jtr
Name 4,4'-Bis(4-n-hexylphenylamino)-5,5'-bis(4-n-hexylphenylimino)-2,5,2',5'-tetrahydro-1H,1'H-2,2'-ethane-1,2-diylidenebisimidazole
Alternate Name(s) (2Z,5Z)-N-(4-hexylphenyl)-2-{2-[(2Z,5E)-4-[(4-hexylphenyl)amino]-5-[(4-hexylphenyl)imino]-2,5-dihydro-1H-imidazol-2-ylidene]ethylidene}-5-[(4-hexylphenyl)imino]-2,5-dihydro-1H-imidazol-4-amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C56H74N8
InChI InChI=1S/C56H74N8/c1-5-9-13-17-21-43-25-33-47(34-26-43)57-53-54(58-48-35-27-44(28-36-48)22-18-14-10-6-2)62-51(61-53)41-42-52-63-55(59-49-37-29-45(30-38-49)23-19-15-11-7-3)56(64-52)60-50-39-31-46(32-40-50)24-20-16-12-8-4/h25-42H,5-24H2,1-4H3,(H,57,61)(H,58,62)(H,59,63)(H,60,64)
InChIKey BQEXVUVDVMSQHD-UHFFFAOYSA-N
Molecular Weight 859.264 g/mol
SMILES N1\C(C(=N\C1=C\C=C\1N=C(\C(N1)=N\c1ccc(cc1)CCCCCC)Nc1ccc(cc1)CCCCCC)Nc1ccc(cc1)CCCCCC)=N/c1ccc(cc1)CCCCCC
SPLASH splash10-0f79-2940000010-eb4deadf5e625dc892c2
Source of Spectrum SO-0-1303-4
Wiley ID 874032