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3-(2-nitro-1-imidazolyl)propanoic acid methyl ester
SpectraBase Compound ID GzPsWxWCWKU
InChI InChI=1S/C7H9N3O4/c1-14-6(11)2-4-9-5-3-8-7(9)10(12)13/h3,5H,2,4H2,1H3
InChIKey KIVRPCMCGGHVCW-UHFFFAOYSA-N
Mol Weight 199.17 g/mol
Molecular Formula C7H9N3O4
Exact Mass 199.059306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vFn4c8BG2b
Name 3-(2-nitro-1-imidazolyl)propanoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C7H9N3O4
InChI InChI=1S/C7H9N3O4/c1-14-6(11)2-4-9-5-3-8-7(9)10(12)13/h3,5H,2,4H2,1H3
InChIKey KIVRPCMCGGHVCW-UHFFFAOYSA-N
Molecular Weight 199.166 g/mol
SMILES C(CC[n]1c(ncc1)N(=O)=O)(=O)OC
SPLASH splash10-0udi-0900000000-4847e39f3d934f0b9a9f
Source of Spectrum SO-0-711-9
Synonyms 3-(2-nitroimidazol-1-yl)propionic acid methyl ester methyl 3-(2-nitroimidazol-1-yl)propanoate
Wiley ID 1542470