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CHEBI:141562 - 2-methyl-1-pentene

ChEBI IDCHEBI:141562
ChEBI Name2-methyl-1-pentene
Stars
DefinitionAn alkene that is pent-1-ene carrying a methyl group at position 2.
Last Modified18 June 2019
Submittermwilliams
DownloadsMolfile
FormulaC6H12
Net Charge0
Average Mass84.162
Monoisotopic Mass84.09390
SMILESC=C(C)CCC
InChIInChI=1S/C6H12/c1-4-5-6(2)3/h2,4-5H2,1,3H3
InChIKeyWWUVJRULCWHUSA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (21386193) Detected in human breath samples.
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
2-methyl-1-pentene (CHEBI:141562) has parent hydride pentane (CHEBI:37830)
2-methyl-1-pentene (CHEBI:141562) has role human metabolite (CHEBI:77746)
2-methyl-1-pentene (CHEBI:141562) is a alkene (CHEBI:32878)
2-methyl-1-pentene (CHEBI:141562) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
2-methylpent-1-ene
Synonyms  Source
2-methylpenteneChemIDplus
2-methyl-1-penteneChEBI
2-methyl-pentene-1NIST Chemistry WebBook
4-methyl-4-penteneNIST Chemistry WebBook
Manual XrefsDatabases
12446ChemSpider
Registry NumbersSources
Reaxys:1340499Reaxys
CAS:763-29-1ChemIDplus
CAS:763-29-1NIST Chemistry WebBook
Citations