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N'-heptyl-N-[12-[[4-[heptyl(methyl)amino]-1,4-dioxobutyl]amino]dodecyl]-N'-methylbutanediamide
SpectraBase Compound ID DKK00gQa9Us
InChI InChI=1S/C36H70N4O4/c1-5-7-9-19-23-31-39(3)35(43)27-25-33(41)37-29-21-17-15-13-11-12-14-16-18-22-30-38-34(42)26-28-36(44)40(4)32-24-20-10-8-6-2/h5-32H2,1-4H3,(H,37,41)(H,38,42)
InChIKey QEOMNVGFDVWODE-UHFFFAOYSA-N
Mol Weight 623.0 g/mol
Molecular Formula C36H70N4O4
Exact Mass 622.539707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILERiPmL8sB
Name N'-heptyl-N-[12-[[4-[heptyl(methyl)amino]-1,4-dioxobutyl]amino]dodecyl]-N'-methylbutanediamide
Alternate Name(s) N'-heptyl-N-[12-[[4-[heptyl(methyl)amino]-4-keto-butanoyl]amino]dodecyl]-N'-methyl-succinamide N'-heptyl-N-[12-[[4-[heptyl(methyl)amino]-4-oxidanylidene-butanoyl]amino]dodecyl]-N'-methyl-butanediamide N'-heptyl-N-[12-[[4-[heptyl(methyl)amino]-4-oxo-butanoyl]amino]dodecyl]-N'-methyl-butanediamide
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Formula C36H70N4O4
InChI InChI=1S/C36H70N4O4/c1-5-7-9-19-23-31-39(3)35(43)27-25-33(41)37-29-21-17-15-13-11-12-14-16-18-22-30-38-34(42)26-28-36(44)40(4)32-24-20-10-8-6-2/h5-32H2,1-4H3,(H,37,41)(H,38,42)
InChIKey QEOMNVGFDVWODE-UHFFFAOYSA-N
Molecular Weight 622.980 g/mol
SMILES N(CCCCCCCCCCCCNC(CCC(N(C)CCCCCCC)=O)=O)C(=O)CCC(=O)N(C)CCCCCCC
SPLASH splash10-06r6-9521000000-d0cff760e454e7f0886c
Wiley ID 1486758