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N,N'-bis{[2-(4'-Phenylamino)phenylamino]butyl}benzene-1,3-dimethanamine
SpectraBase Compound ID L0tKXfRFsRc
InChI InChI=1S/C40H48N6/c1-3-33(43-37-18-22-39(23-19-37)45-35-14-7-5-8-15-35)29-41-27-31-12-11-13-32(26-31)28-42-30-34(4-2)44-38-20-24-40(25-21-38)46-36-16-9-6-10-17-36/h5-26,33-34,41-46H,3-4,27-30H2,1-2H3
InChIKey ZOFRRDMQBVBMOT-UHFFFAOYSA-N
Mol Weight 612.9 g/mol
Molecular Formula C40H48N6
Exact Mass 612.394046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cTKs6VaVWF
Name N,N'-bis{[2-(4'-Phenylamino)phenylamino]butyl}benzene-1,3-dimethanamine
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Formula C40H48N6
InChI InChI=1S/C40H48N6/c1-3-33(43-37-18-22-39(23-19-37)45-35-14-7-5-8-15-35)29-41-27-31-12-11-13-32(26-31)28-42-30-34(4-2)44-38-20-24-40(25-21-38)46-36-16-9-6-10-17-36/h5-26,33-34,41-46H,3-4,27-30H2,1-2H3
InChIKey ZOFRRDMQBVBMOT-UHFFFAOYSA-N
Molecular Weight 612.866 g/mol
SMILES N(c1ccc(NC(CNCc2cc(CNCC(Nc3ccc(Nc4ccccc4)cc3)CC)ccc2)CC)cc1)c1ccccc1
SPLASH splash10-001i-1910001000-5a3463f878659e1bfa7d
Source of Spectrum D8-327-402-14
Synonyms N(1)-[1-({[3-({[2-(4-anilinoanilino)butyl]amino}methyl)benzyl]amino}methyl)propyl]-N(4)-phenyl-1,4-benzenediamine N-[2-(4-anilinoanilino)butyl]-N-[3-({[2-(4-anilinoanilino)butyl]amino}methyl)benzyl]amine
Wiley ID 1515275