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2-methyl-5-nitroimidazole-1-acetic acid, ethyl ester
SpectraBase Compound ID 9W9WnNlKRi1
InChI InChI=1S/C8H11N3O4/c1-3-15-8(12)5-10-6(2)9-4-7(10)11(13)14/h4H,3,5H2,1-2H3
InChIKey CKGGIKOPFUMXET-UHFFFAOYSA-N
Mol Weight 213.19 g/mol
Molecular Formula C8H11N3O4
Exact Mass 213.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fbfb8o5zge1
Name 1H-Imidazole-1-acetic acid, 2-methyl-5-nitro-, ethyl ester
Alternate Name(s) Ethyl (2-methyl-5-nitro-1H-imidazol-1-yl)acetate 2-(2-Methyl-5-nitro-1-imidazolyl)acetic acid ethyl ester 2-(2-Methyl-5-nitro-imidazol-1-yl)acetic acid ethyl ester 2-Methyl-5-nitroimidazole-1-acetic acid, ethyl ester Ethyl 2-(2-methyl-5-nitro-imidazol-1-yl)acetate Ethyl 2-(2-methyl-5-nitro-imidazol-1-yl)ethanoate Imidazole-1-acetic acid, 2-methyl-5-nitro-, ethyl ester BRN 0617040
CAS Registry Number 1016-40-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11N3O4
InChI InChI=1S/C8H11N3O4/c1-3-15-8(12)5-10-6(2)9-4-7(10)11(13)14/h4H,3,5H2,1-2H3
InChIKey CKGGIKOPFUMXET-UHFFFAOYSA-N
Molecular Weight 213.193 g/mol
SMILES c1c([n](c(C)n1)CC(=O)OCC)N(=O)=O
SPLASH splash10-0uxr-9410000000-0deadabf1d6175688b96
Source of Spectrum RP-0-210-5
Wiley ID 1212346