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CHEBI:86297 - picrate anion

ChEBI IDCHEBI:86297
ChEBI Namepicrate anion
Stars
DefinitionA phenolate anion resulting from deprotonation of the phenolic hydroxy group of picric acid.
Last Modified2 July 2015
SubmitterGareth Owen
DownloadsMolfile
FormulaC6H2N3O7
Net Charge-1
Average Mass228.096
Monoisotopic Mass227.98982
SMILESO=[N+]([O-])c1cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c1
InChIInChI=1S/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H/p-1
InChIKeyOXNIZHLAWKMVMX-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
picrate anion (CHEBI:86297) is a phenolate anion (CHEBI:50525)
picrate anion (CHEBI:86297) is conjugate base of picric acid (CHEBI:46149)
Incoming Relation(s)
butamben picrate (CHEBI:86300) has part picrate anion (CHEBI:86297)
picric acid (CHEBI:46149) is conjugate acid of picrate anion (CHEBI:86297)
IUPAC Names 
2,4,6-trinitrophenoxide
2,4,6-trinitrophenolate
Synonyms  Source
picrateChEBI
2,4,6-trinitrophenoxide ionChEBI
picrate ionChEBI
2,4,6-trinitrophenolate ionChEBI
Manual XrefsDatabases
CPD-17566MetaCyc
Registry NumbersSources
Reaxys:3595189Reaxys