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N,N''-[2-(4-Phenylbutyl-N-ethoxycarbonyl-3-aminopropyl)-propane-1,3-diyl]-bis-N-4-phenylbutylcarbamic acid ethylester
SpectraBase Compound ID GOBNpH8ekhs
InChI InChI=1S/C45H65N3O6/c1-4-52-43(49)46(33-19-16-29-39-23-10-7-11-24-39)36-22-32-42(37-47(44(50)53-5-2)34-20-17-30-40-25-12-8-13-26-40)38-48(45(51)54-6-3)35-21-18-31-41-27-14-9-15-28-41/h7-15,23-28,42H,4-6,16-22,29-38H2,1-3H3
InChIKey GJHYKHYYRLEFCC-UHFFFAOYSA-N
Mol Weight 744.0 g/mol
Molecular Formula C45H65N3O6
Exact Mass 743.487337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GqQ9clUwoQ
Name N,N''-[2-(4-Phenylbutyl-N-ethoxycarbonyl-3-aminopropyl)-propane-1,3-diyl]-bis-N-4-phenylbutylcarbamic acid ethylester
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Formula C45H65N3O6
InChI InChI=1S/C45H65N3O6/c1-4-52-43(49)46(33-19-16-29-39-23-10-7-11-24-39)36-22-32-42(37-47(44(50)53-5-2)34-20-17-30-40-25-12-8-13-26-40)38-48(45(51)54-6-3)35-21-18-31-41-27-14-9-15-28-41/h7-15,23-28,42H,4-6,16-22,29-38H2,1-3H3
InChIKey GJHYKHYYRLEFCC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19913240509
Molecular Weight 744.030 g/mol
SMILES C(N(C(=O)OCC)CCCCc1ccccc1)C(CN(C(=O)OCC)CCCCc1ccccc1)CCCN(CCCCc1ccccc1)C(=O)OCC
SPLASH splash10-000x-9364121400-d7a811ff0956594196fc
Source of Spectrum APC-324-304-RE2112C
Synonyms Diethyl (2-(((ethoxycarbonyl)(4-phenylbutyl)amino)methyl)pentane-1,5-diyl)bis((4-phenylbutyl)carbamate)
Wiley ID 1800714