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CHEBI:228650 - isonicotinaldehyde 4-(5-methyl-2,4-dinitrophenyl)hydrazone

ChEBI IDCHEBI:228650
ChEBI Nameisonicotinaldehyde 4-(5-methyl-2,4-dinitrophenyl)hydrazone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H11N5O4
Net Charge0
Average Mass301.262
Monoisotopic Mass301.08110
SMILESCc1cc(N/N=C/c2ccncc2)c([N+](=O)[O-])cc1[N+](=O)[O-]
InChIInChI=1S/C13H11N5O4/c1-9-6-11(13(18(21)22)7-12(9)17(19)20)16-15-8-10-2-4-14-5-3-10/h2-8,16H,1H3/b15-8+
InChIKeyCIKUIMKRJSJDRZ-OVCLIPMQSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
isonicotinaldehyde 4-(5-methyl-2,4-dinitrophenyl)hydrazone (CHEBI:228650) is a dinitrotoluene (CHEBI:23822)
IUPAC Name 
5-methyl-2,4-dinitro-N-[(E)-pyridin-4-ylmethylideneamino]aniline
Manual XrefsDatabases
7857425ChemSpider