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3-(1-Methyl-5-nitro-2-imidazolyl)-3-oxopropanoic acid ethyl ester
SpectraBase Compound ID DOjagxg4FIl
InChI InChI=1S/C9H11N3O5/c1-3-17-8(14)4-6(13)9-10-5-7(11(9)2)12(15)16/h5H,3-4H2,1-2H3
InChIKey XASRUNSYTTXAMP-UHFFFAOYSA-N
Mol Weight 241.2 g/mol
Molecular Formula C9H11N3O5
Exact Mass 241.06987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2asV71eXwS
Name 3-(1-Methyl-5-nitro-2-imidazolyl)-3-oxopropanoic acid ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11N3O5
InChI InChI=1S/C9H11N3O5/c1-3-17-8(14)4-6(13)9-10-5-7(11(9)2)12(15)16/h5H,3-4H2,1-2H3
InChIKey XASRUNSYTTXAMP-UHFFFAOYSA-N
Molecular Weight 241.203 g/mol
SMILES c1([n](c(C(CC(=O)OCC)=O)nc1)C)N(=O)=O
SPLASH splash10-0ktg-5920000000-27561827f40d32c5826e
Source of Spectrum Y-29-1023-10
Synonyms 3-keto-3-(1-methyl-5-nitro-imidazol-2-yl)propionic acid ethyl ester Ethyl 3-(1-methyl-5-nitro-imidazol-2-yl)-3-oxidanylidene-propanoate Ethyl 3-(1-methyl-5-nitro-imidazol-2-yl)-3-oxo-propanoate
Wiley ID 1243788