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5-Iodo-3-nitro-1-trifluoromethylbenzene
SpectraBase Compound ID 4lmSas2LuoM
InChI InChI=1S/C7H3F3INO2/c8-7(9,10)4-1-5(11)3-6(2-4)12(13)14/h1-3H
InChIKey BANTUHUNKDGMCA-UHFFFAOYSA-N
Mol Weight 317.01 g/mol
Molecular Formula C7H3F3INO2
Exact Mass 316.916058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gt41B2uRb9
Name 5-Iodo-3-nitro-1-trifluoromethylbenzene
Alternate Name(s) 1-iodanyl-3-nitro-5-(trifluoromethyl)benzene 1-iodo-3-nitro-5-(trifluoromethyl)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C7H3F3INO2
InChI InChI=1S/C7H3F3INO2/c8-7(9,10)4-1-5(11)3-6(2-4)12(13)14/h1-3H
InChIKey BANTUHUNKDGMCA-UHFFFAOYSA-N
Molecular Weight 317.006 g/mol
SMILES c1(cc(cc(c1)I)N(=O)=O)C(F)(F)F
SPLASH splash10-014i-0029000000-9f9df91c0928446264d5
Source of Spectrum KC-0-1663-0
Wiley ID 786002