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4-(Dicyclohexylamino)-4-oxobutanoic acid
SpectraBase Compound ID 1NQpmZctTLM
InChI InChI=1S/C16H27NO3/c18-15(11-12-16(19)20)17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12H2,(H,19,20)
InChIKey VFNKILUAADEGCH-UHFFFAOYSA-N
Mol Weight 281.4 g/mol
Molecular Formula C16H27NO3
Exact Mass 281.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hrqWptPswJ
Name 4-(Dicyclohexylamino)-4-oxobutanoic acid
Alternate Name(s) 4-(dicyclohexylamino)-4-keto-butyric acid 4-(dicyclohexylamino)-4-oxidanylidene-butanoic acid Butanoic acid, 4-dicyclohexylamino-4-oxo-
CAS Registry Number 328013-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO3
InChI InChI=1S/C16H27NO3/c18-15(11-12-16(19)20)17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12H2,(H,19,20)
InChIKey VFNKILUAADEGCH-UHFFFAOYSA-N
Molecular Weight 281.396 g/mol
SMILES OC(CCC(N(C1CCCCC1)C1CCCCC1)=O)=O
SPLASH splash10-0a4u-9300000000-4f66ebbb06f1ed1b4882
Source of Spectrum AD-0-2532-0
Wiley ID 1431884