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N-(6-acetamidohexyl)-N',N'-dioctyl-malonamide
SpectraBase Compound ID IfSXW4WnDu4
InChI InChI=1S/C27H53N3O3/c1-4-6-8-10-14-18-22-30(23-19-15-11-9-7-5-2)27(33)24-26(32)29-21-17-13-12-16-20-28-25(3)31/h4-24H2,1-3H3,(H,28,31)(H,29,32)
InChIKey NEISAPLOHPKTEM-UHFFFAOYSA-N
Mol Weight 467.7 g/mol
Molecular Formula C27H53N3O3
Exact Mass 467.408693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pMjJhY5QMF
Name N-(6-acetamidohexyl)-N',N'-dioctyl-malonamide
Alternate Name(s) N-(6-acetamidohexyl)-N',N'-dioctyl-propanediamide N-(6-Acetylaminohexyl)-N',N'-dioctylmalonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H53N3O3
InChI InChI=1S/C27H53N3O3/c1-4-6-8-10-14-18-22-30(23-19-15-11-9-7-5-2)27(33)24-26(32)29-21-17-13-12-16-20-28-25(3)31/h4-24H2,1-3H3,(H,28,31)(H,29,32)
InChIKey NEISAPLOHPKTEM-UHFFFAOYSA-N
Molecular Weight 467.739 g/mol
SMILES N(C(CC(N(CCCCCCCC)CCCCCCCC)=O)=O)CCCCCCNC(=O)C
SPLASH splash10-0006-9771000000-5b0cf25b1eb768d2eb92
Wiley ID 1486695