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1-[2'-Cyanoethyl]-13-acetoxy-1-azacyclohexadecan-2-one
SpectraBase Compound ID Ol7nUf9BZe
InChI InChI=1S/C20H34N2O3/c1-18(23)25-19-12-8-6-4-2-3-5-7-9-14-20(24)22(16-10-13-19)17-11-15-21/h19H,2-14,16-17H2,1H3
InChIKey NJCZLUPJXUAQDV-UHFFFAOYSA-N
Mol Weight 350.5 g/mol
Molecular Formula C20H34N2O3
Exact Mass 350.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1E7Kw0SKCNF
Name 1-[2'-Cyanoethyl]-13-acetoxy-1-azacyclohexadecan-2-one
Alternate Name(s) 1-(2-cyanoethyl)-16-oxoazacyclohexadecan-5-yl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C20H34N2O3
InChI InChI=1S/C20H34N2O3/c1-18(23)25-19-12-8-6-4-2-3-5-7-9-14-20(24)22(16-10-13-19)17-11-15-21/h19H,2-14,16-17H2,1H3
InChIKey NJCZLUPJXUAQDV-UHFFFAOYSA-N
Molecular Weight 350.503 g/mol
SMILES C1(N(CCCC(CCCCCCCCCC1)OC(=O)C)CCC#N)=O
SPLASH splash10-0006-9003000000-a55a4253d564643178d1
Source of Spectrum H-76-1641-21
Wiley ID 1342028