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CHEBI:230808 - 4,6-Dimethyl-1-nitro-4-(trifluoromethyl)cyclohexene

ChEBI IDCHEBI:230808
ChEBI Name4,6-Dimethyl-1-nitro-4-(trifluoromethyl)cyclohexene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12F3NO2
Net Charge0
Average Mass223.194
Monoisotopic Mass223.08201
SMILESCC1CC(C)(C(F)(F)F)CC=C1[N+](=O)[O-]
InChIInChI=1S/C9H12F3NO2/c1-6-5-8(2,9(10,11)12)4-3-7(6)13(14)15/h3,6H,4-5H2,1-2H3
InChIKeyJOLGUHSEMPNHSK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
4,6-Dimethyl-1-nitro-4-(trifluoromethyl)cyclohexene (CHEBI:230808) is a C-nitro compound (CHEBI:35716)
IUPAC Name 
4,6-dimethyl-1-nitro-4-(triluoromethyl)cyclohexene
Manual XrefsDatabases
HMDB0260288HMDB