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4-Nitro-1H-imidazole-5-carboxylic acid ethyl ester
SpectraBase Compound ID 7NUJF20A6Zn
InChI InChI=1S/C6H7N3O4/c1-2-13-6(10)4-5(9(11)12)8-3-7-4/h3H,2H2,1H3,(H,7,8)
InChIKey JFHZQABGMJXACV-UHFFFAOYSA-N
Mol Weight 185.14 g/mol
Molecular Formula C6H7N3O4
Exact Mass 185.043656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0FvVzcdduC
Name 4-Nitro-1H-imidazole-5-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 4-nitro-1H-imidazole-5-carboxylate
CAS Registry Number 74478-95-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7N3O4
InChI InChI=1S/C6H7N3O4/c1-2-13-6(10)4-5(9(11)12)8-3-7-4/h3H,2H2,1H3,(H,7,8)
InChIKey JFHZQABGMJXACV-UHFFFAOYSA-N
Molecular Weight 185.139 g/mol
SMILES [nH]1cnc(c1C(=O)OCC)N(=O)=O
SPLASH splash10-014r-9400000000-e4c34a9ac12bce7e7521
Wiley ID 1512074