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1H-imidazole-1-acetic acid, 2-methyl-4-nitro-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-imidazole-1-acetic acid, 2-methyl-4-nitro-, methyl ester
SpectraBase Compound ID 7EPxDYnZswW
InChI InChI=1S/C7H9N3O4/c1-5-8-6(10(12)13)3-9(5)4-7(11)14-2/h3H,4H2,1-2H3
InChIKey UBPSDJINTHTAGK-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 CKtOxJSmjG7
Name 2-(2-Methyl-4-nitro-1-imidazolyl)acetic acid methyl ester
Alternate Name(s) 2-(2-Methyl-4-nitro-imidazol-1-yl)acetic acid methyl ester Methyl (2-methyl-4-nitro-1H-imidazol-1-yl)acetate Methyl 2-(2-methyl-4-nitro-imidazol-1-yl)acetate Methyl 2-(2-methyl-4-nitro-imidazol-1-yl)ethanoate
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Formula C7H9N3O4
InChI InChI=1S/C7H9N3O4/c1-5-8-6(10(12)13)3-9(5)4-7(11)14-2/h3H,4H2,1-2H3
InChIKey UBPSDJINTHTAGK-UHFFFAOYSA-N
Molecular Weight 199.166 g/mol
SMILES c1(nc(C)[n](c1)CC(=O)OC)N(=O)=O
SPLASH splash10-0007-9300000000-fdc58c9b5f328e885eb0
Wiley ID 1512098