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CHEBI:187668 - 2,2,4-trimethylhexane

ChEBI IDCHEBI:187668
ChEBI Name2,2,4-trimethylhexane
Stars
Last Modified3 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H20
Net Charge0
Average Mass128.259
Monoisotopic Mass128.15650
SMILESCCC(C)CC(C)(C)C
InChIInChI=1S/C9H20/c1-6-8(2)7-9(3,4)5/h8H,6-7H2,1-5H3
InChIKeyAFTPEBDOGXRMNQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
2,2,4-trimethylhexane (CHEBI:187668) is a alkane (CHEBI:18310)
IUPAC Name 
2,2,4-trimethylhexane
Manual XrefsDatabases
LMFA11000333LIPID MAPS
26064ChemSpider
Registry NumbersSources
CAS:16747-26-5ChemIDplus