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CHEBI:84286 - 3-methoxy-3-methylhexane

ChEBI IDCHEBI:84286
ChEBI Name3-methoxy-3-methylhexane
Stars
DefinitionAn ether consists of a hexane chain substituted by a methoxy and a methyl group at position 3.
Last Modified13 January 2015
Submitternamrata
DownloadsMolfile
FormulaC8H18O
Net Charge0
Average Mass130.231
Monoisotopic Mass130.13577
SMILESCCCC(C)(CC)OC
InChIInChI=1S/C8H18O/c1-5-7-8(3,6-2)9-4/h5-7H2,1-4H3
InChIKeyPCSFHUVPGSODTP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - MetaboLights (MTBLS152)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
3-methoxy-3-methylhexane (CHEBI:84286) has parent hydride hexane (CHEBI:29021)
3-methoxy-3-methylhexane (CHEBI:84286) has role human metabolite (CHEBI:77746)
3-methoxy-3-methylhexane (CHEBI:84286) is a ether (CHEBI:25698)
IUPAC Name 
3-methoxy-3-methylhexane
Synonym  Source
methyl 3-methylhexan-3-yl etherIUPAC
Registry NumbersSources
Reaxys:6081897Reaxys