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CHEBI:231530 - 2,4,6-trinitrotoluene radical

ChEBI IDCHEBI:231530
ChEBI Name2,4,6-trinitrotoluene radical
Stars
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC7H6N3O6
Net Charge0
Average Mass228.140
Monoisotopic Mass228.02566
SMILESCc1c([N+](=O)[O-])cc(N([O])O)cc1[N+](=O)[O-]
InChIInChI=1S/C7H6N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3,11H,1H3
InChIKeyYYEVVKDDTNYDFM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,4,6-trinitrotoluene radical (CHEBI:231530) is a organic radical (CHEBI:36872)
2,4,6-trinitrotoluene radical (CHEBI:231530) is a trinitrotoluene (CHEBI:27135)
Synonym  Source
TNT radicalSUBMITTER
UniProt Name  Source
2,4,6-trinitrotoluene radicalUniProt
Citations