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5-IODO-1-METHYL-4-NITROIMIDAZOLE
SpectraBase Compound ID ENgIFzXbUzx
InChI InChI=1S/C4H4IN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3
InChIKey UMJDVASWYFUEJL-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 EmZwg0zuXmA
Name 5-iodanyl-1-methyl-4-nitro-imidazole
Alternate Name(s) 5-iodo-1-methyl-4-nitro-1H-imidazole 5-iodo-1-methyl-4-nitro-imidazole
CAS Registry Number 35681-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4IN3O2
InChI InChI=1S/C4H4IN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3
InChIKey UMJDVASWYFUEJL-UHFFFAOYSA-N
Molecular Weight 252.999 g/mol
SMILES c1(N(=O)=O)c([n](C)cn1)I
SPLASH splash10-0gc0-9810000000-c85b95851b3fad6a4dbf
Source of Spectrum KO-8-355-2
Wiley ID 1256485