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2-Nitro-5-oxo-2-(3-oxobutyl)hexanoic acid ethyl ester
SpectraBase Compound ID CrPIPj5WUVB
InChI InChI=1S/C12H19NO6/c1-4-19-11(16)12(13(17)18,7-5-9(2)14)8-6-10(3)15/h4-8H2,1-3H3
InChIKey GVDXNCHBDDAVSX-UHFFFAOYSA-N
Mol Weight 273.28 g/mol
Molecular Formula C12H19NO6
Exact Mass 273.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tDY8BDj3M
Name 2-Nitro-5-oxo-2-(3-oxobutyl)hexanoic acid ethyl ester
Alternate Name(s) 5-keto-2-(3-ketobutyl)-2-nitro-hexanoic acid ethyl ester Ethyl 2-nitro-5-oxidanylidene-2-(3-oxidanylidenebutyl)hexanoate Ethyl 2-nitro-5-oxo-2-(3-oxobutyl)hexanoate
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Formula C12H19NO6
InChI InChI=1S/C12H19NO6/c1-4-19-11(16)12(13(17)18,7-5-9(2)14)8-6-10(3)15/h4-8H2,1-3H3
InChIKey GVDXNCHBDDAVSX-UHFFFAOYSA-N
Molecular Weight 273.285 g/mol
SMILES C(N(=O)=O)(C(=O)OCC)(CCC(=O)C)CCC(=O)C
SPLASH splash10-0006-9100000000-e43d3ee982894a5a9e98
Source of Spectrum F-55-3945-10
Wiley ID 837268