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3-(5-iodanyl-2-methyl-4-nitro-imidazol-1-yl)propanenitrile
SpectraBase Compound ID 9ZRsWSYuy7I
InChI InChI=1S/C7H7IN4O2/c1-5-10-7(12(13)14)6(8)11(5)4-2-3-9/h2,4H2,1H3
InChIKey MGRYBEXDDDGHFN-UHFFFAOYSA-N
Mol Weight 306.06 g/mol
Molecular Formula C7H7IN4O2
Exact Mass 305.96137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lp1q70EuF8
Name 3-(5-iodanyl-2-methyl-4-nitro-imidazol-1-yl)propanenitrile
Alternate Name(s) 3-(5-iodo-2-methyl-4-nitro-1-imidazolyl)propanenitrile 3-(5-iodo-2-methyl-4-nitro-imidazol-1-yl)propanenitrile 3-(5-iodo-2-methyl-4-nitro-imidazol-1-yl)propionitrile
Comments Less than 3 mono-isotopic peaks
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Formula C7H7IN4O2
InChI InChI=1S/C7H7IN4O2/c1-5-10-7(12(13)14)6(8)11(5)4-2-3-9/h2,4H2,1H3
InChIKey MGRYBEXDDDGHFN-UHFFFAOYSA-N
Molecular Weight 306.063 g/mol
SMILES c1(nc(C)[n](c1I)CCC#N)N(=O)=O
SPLASH splash10-0a4i-0009000000-b8645d1b45836a460a8c
Source of Spectrum SK-24-360-2
Wiley ID 866046