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N,N'-bis(4"-Phenylbutyl)-2-[(4'-phenylbutyl)aminomethyl]heptane-1,7-diamine
SpectraBase Compound ID DYacsqWqXBJ
InChI InChI=1S/C38H57N3/c1-5-19-35(20-6-1)25-12-16-30-39-29-15-4-11-28-38(33-40-31-17-13-26-36-21-7-2-8-22-36)34-41-32-18-14-27-37-23-9-3-10-24-37/h1-3,5-10,19-24,38-41H,4,11-18,25-34H2
InChIKey FAOXDWQUCQJJBT-UHFFFAOYSA-N
Mol Weight 555.9 g/mol
Molecular Formula C38H57N3
Exact Mass 555.455249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HO5aM2Fejn
Name N,N'-bis(4"-Phenylbutyl)-2-[(4'-phenylbutyl)aminomethyl]heptane-1,7-diamine
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Formula C38H57N3
InChI InChI=1S/C38H57N3/c1-5-19-35(20-6-1)25-12-16-30-39-29-15-4-11-28-38(33-40-31-17-13-26-36-21-7-2-8-22-36)34-41-32-18-14-27-37-23-9-3-10-24-37/h1-3,5-10,19-24,38-41H,4,11-18,25-34H2
InChIKey FAOXDWQUCQJJBT-UHFFFAOYSA-N
Molecular Weight 555.895 g/mol
SMILES N(CC(CCCCCNCCCCc1ccccc1)CNCCCCc1ccccc1)CCCCc1ccccc1
SPLASH splash10-0006-9542020000-00cf9b2903431adf38d2
Source of Spectrum D8-324-246-26
Synonyms N(1),N(7)-bis(4-phenylbutyl)-2-{[(4-phenylbutyl)amino]methyl}-1,7-heptanediamine N,N'-bis(4''-Phenylbutyl)-2-[(4'-phenylbutyl)aminomethyl]heptane-1,7-diamine-trihydrochloride N-(4-phenylbutyl)-N-(7-[(4-phenylbutyl)amino]-2-{[(4-phenylbutyl)amino]methyl}heptyl)amine
Wiley ID 1514061