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2-iodanyl-1,3-dinitro-benzene
SpectraBase Compound ID f21uMCyaWQ
InChI InChI=1S/C6H3IN2O4/c7-6-4(8(10)11)2-1-3-5(6)9(12)13/h1-3H
InChIKey PYNOEYZGLYTFIP-UHFFFAOYSA-N
Mol Weight 294.0 g/mol
Molecular Formula C6H3IN2O4
Exact Mass 293.913752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ivu7bLGxBlA
Name 2-iodanyl-1,3-dinitro-benzene
Alternate Name(s) 2-iodo-1,3-dinitro-benzene
Comments Less than 3 mono-isotopic peaks
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Formula C6H3IN2O4
InChI InChI=1S/C6H3IN2O4/c7-6-4(8(10)11)2-1-3-5(6)9(12)13/h1-3H
InChIKey PYNOEYZGLYTFIP-UHFFFAOYSA-N
Molecular Weight 294.004 g/mol
SMILES c1(c(cccc1N(=O)=O)N(=O)=O)I
SPLASH splash10-002f-5090000000-50e85d71b34aab0dbac6
Source of Spectrum F-56-170-1
Wiley ID 855426