EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:112912 - N-[2-(2,4,6-trinitrophenyl)ethyl]aniline

ChEBI IDCHEBI:112912
ChEBI NameN-[2-(2,4,6-trinitrophenyl)ethyl]aniline
Stars
DownloadsMolfile
FormulaC14H12N4O6
Net Charge0
Average Mass332.272
Monoisotopic Mass332.07568
SMILESO=[N+]([O-])c1cc([N+](=O)[O-])c(CCNc2ccccc2)c([N+](=O)[O-])c1
InChIInChI=1S/C14H12N4O6/c19-16(20)11-8-13(17(21)22)12(14(9-11)18(23)24)6-7-15-10-4-2-1-3-5-10/h1-5,8-9,15H,6-7H2
InChIKeyWPDUWQVPOYWUIS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-(2,4,6-trinitrophenyl)ethyl]aniline (CHEBI:112912) is a C-nitro compound (CHEBI:35716)
Manual XrefsDatabases
LSM-24322LINCS