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4-BROMO-1,2-DIMETHYL-5-NITROIMIDAZOLE
SpectraBase Compound ID KKmTe3SZz2E
InChI InChI=1S/C5H6BrN3O2/c1-3-7-4(6)5(8(3)2)9(10)11/h1-2H3
InChIKey ZNTMHCHYIKJJMI-UHFFFAOYSA-N
Mol Weight 220.03 g/mol
Molecular Formula C5H6BrN3O2
Exact Mass 218.964339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQItKpZhPKe
Name Imidazole, 4-bromo-1,2-dimethyl-5-nitro-
Alternate Name(s) 4-Bromo-1,2-dimethyl-5-nitro-1H-imidazole 4-Bromanyl-1,2-dimethyl-5-nitro-imidazole 4-Bromo-1,2-dimethyl-5-nitro-imidazole
CAS Registry Number 21431-58-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6BrN3O2
InChI InChI=1S/C5H6BrN3O2/c1-3-7-4(6)5(8(3)2)9(10)11/h1-2H3
InChIKey ZNTMHCHYIKJJMI-UHFFFAOYSA-N
Molecular Weight 220.026 g/mol
SMILES Cc1nc(c([n]1C)N(=O)=O)Br
SPLASH splash10-0100-0950000000-66bac0ae8bc98f43d8db
Source of Spectrum B-40-1408-6
Wiley ID 1218543