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N'-heptyl-N-[[3-[[[3-[heptyl(methyl)amino]-1,3-dioxopropyl]amino]methyl]cyclohexyl]methyl]-N'-methylpropanediamide
SpectraBase Compound ID B38urCgXtxi
InChI InChI=1S/C30H56N4O4/c1-5-7-9-11-13-18-33(3)29(37)21-27(35)31-23-25-16-15-17-26(20-25)24-32-28(36)22-30(38)34(4)19-14-12-10-8-6-2/h25-26H,5-24H2,1-4H3,(H,31,35)(H,32,36)/t25-,26-/m1/s1
InChIKey AJVMDGLIPPPAFX-CLJLJLNGSA-N
Mol Weight 536.8 g/mol
Molecular Formula C30H56N4O4
Exact Mass 536.430156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbTurOXhe1p
Name N'-heptyl-N-[[3-[[[3-[heptyl(methyl)amino]-1,3-dioxopropyl]amino]methyl]cyclohexyl]methyl]-N'-methylpropanediamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H56N4O4
InChI InChI=1S/C30H56N4O4/c1-5-7-9-11-13-18-33(3)29(37)21-27(35)31-23-25-16-15-17-26(20-25)24-32-28(36)22-30(38)34(4)19-14-12-10-8-6-2/h25-26H,5-24H2,1-4H3,(H,31,35)(H,32,36)/t25-,26-/m1/s1
InChIKey AJVMDGLIPPPAFX-CLJLJLNGSA-N
Molecular Weight 536.802 g/mol
SMILES N(C[C@]1(C[C@](CNC(=O)CC(=O)N(C)CCCCCCC)(CCC1)[H])[H])C(=O)CC(=O)N(C)CCCCCCC
SPLASH splash10-0a4l-9511000000-0eda1e279863d26c017c
Synonyms N'-heptyl-N-[[3-[[[3-[heptyl(methyl)amino]-3-keto-propanoyl]amino]methyl]cyclohexyl]methyl]-N'-methyl-malonamide N'-heptyl-N-[[3-[[[3-[heptyl(methyl)amino]-3-oxidanylidene-propanoyl]amino]methyl]cyclohexyl]methyl]-N'-methyl-propanediamide N'-heptyl-N-[[3-[[[3-[heptyl(methyl)amino]-3-oxo-propanoyl]amino]methyl]cyclohexyl]methyl]-N'-methyl-propanediamide
Wiley ID 1486547