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CHEBI:229375 - 2-(4-bromobutyl)-5,5-dimethyl-1,3-Cyclopentadiene

Default Structure
ChEBI IDCHEBI:229375
ChEBI Name2-(4-bromobutyl)-5,5-dimethyl-1,3-Cyclopentadiene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H17Br
Net Charge0
Average Mass229.161
Monoisotopic Mass228.05136
SMILESCC1(C)C=CC(CCCCBr)=C1
InChIInChI=1S/C11H17Br/c1-11(2)7-6-10(9-11)5-3-4-8-12/h6-7,9H,3-5,8H2,1-2H3
InChIKeyUUELMUJSKDEBFA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryctolagus cuniculus (ncbitaxon:9986) longissimus thoracis (BTO:0001651) MetaboLights (MTBLS8958)
ChEBI Ontology
Outgoing Relation(s)
2-(4-bromobutyl)-5,5-dimethyl-1,3-Cyclopentadiene (CHEBI:229375) is a organobromine compound (CHEBI:37141)
IUPAC Name 
2-(4-bromobutyl)-5,5-dimethylcyclopenta-1,3-diene
Manual XrefsDatabases
497445ChemSpider