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1-(2',2'-Dimethoxyethyl)-3-(ethoxycarbonyl)-5-nitropyridin-2(1H)-one
SpectraBase Compound ID 93trf57X0OW
InChI InChI=1S/C12H16N2O7/c1-4-21-12(16)9-5-8(14(17)18)6-13(11(9)15)7-10(19-2)20-3/h5-6,10H,4,7H2,1-3H3
InChIKey SBMLMQLJWTTWOV-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C12H16N2O7
Exact Mass 300.095751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HOiFseQ9x4
Name 1-(2',2'-Dimethoxyethyl)-3-(ethoxycarbonyl)-5-nitropyridin-2(1H)-one
Alternate Name(s) 1-(2,2-dimethoxyethyl)-5-nitro-2-oxo-3-pyridinecarboxylic acid ethyl ester ethyl 1-(2,2-dimethoxyethyl)-5-nitro-2-oxopyridine-3-carboxylate ethyl 1-(2,2-dimethoxyethyl)-5-nitro-2-oxo-pyridine-3-carboxylate ethyl 1-(2,2-dimethoxyethyl)-5-nitro-2-oxidanylidene-pyridine-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C12H16N2O7
InChI InChI=1S/C12H16N2O7/c1-4-21-12(16)9-5-8(14(17)18)6-13(11(9)15)7-10(19-2)20-3/h5-6,10H,4,7H2,1-3H3
InChIKey SBMLMQLJWTTWOV-UHFFFAOYSA-N
Molecular Weight 300.267 g/mol
SMILES C=1(C(N(CC(OC)OC)C=C(C1)N(=O)=O)=O)C(=O)OCC
SPLASH splash10-00di-0090000000-cf297add8a009b657b3b
Source of Spectrum F5-7-330-3d
Wiley ID 1696823