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CHEBI:171997 - 2-Butyl-4-methylphenol

ChEBI IDCHEBI:171997
ChEBI Name2-Butyl-4-methylphenol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O
Net Charge0
Average Mass164.248
Monoisotopic Mass164.12012
SMILESCCCCc1cc(C)ccc1O
InChIInChI=1S/C11H16O/c1-3-4-5-10-8-9(2)6-7-11(10)12/h6-8,12H,3-5H2,1-2H3
InChIKeyFEXBEKLLSUWSIM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
2-Butyl-4-methylphenol (CHEBI:171997) is a hydroxytoluene (CHEBI:24751)
IUPAC Name 
2-butyl-4-methylphenol
Manual XrefsDatabases
73369ChemSpider
HMDB0032060HMDB
Registry NumbersSources
CAS:6891-45-8ChemIDplus