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4-IODO-1-METHYL-5-NITROIMIDAZOLE
SpectraBase Compound ID FOBJp6ReP7K
InChI InChI=1S/C4H4IN3O2/c1-7-2-6-3(5)4(7)8(9)10/h2H,1H3
InChIKey HYIXYWKRGGDKJR-UHFFFAOYSA-N
Mol Weight 253.0 g/mol
Molecular Formula C4H4IN3O2
Exact Mass 252.934821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ddzJXp4uj2
Name 4-iodanyl-1-methyl-5-nitro-imidazole
CAS Registry Number 76529-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4IN3O2
InChI InChI=1S/C4H4IN3O2/c1-7-2-6-3(5)4(7)8(9)10/h2H,1H3
InChIKey HYIXYWKRGGDKJR-UHFFFAOYSA-N
Molecular Weight 252.999 g/mol
SMILES c1(N(=O)=O)c(nc[n]1C)I
SPLASH splash10-0ue9-9740000000-0b267e4400d110f8445e
Source of Spectrum KO-8-355-2
Synonyms 4-iodo-1-methyl-5-nitro-imidazole
Wiley ID 1256483