EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:178388 - 3,5,5-Trimethyl-1-hexanol

ChEBI IDCHEBI:178388
ChEBI Name3,5,5-Trimethyl-1-hexanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H20O
Net Charge0
Average Mass144.258
Monoisotopic Mass144.15142
SMILESCC(CCO)CC(C)(C)C
InChIInChI=1S/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3
InChIKeyBODRLKRKPXBDBN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3,5,5-Trimethyl-1-hexanol (CHEBI:178388) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
3,5,5-trimethylhexan-1-ol
Manual XrefsDatabases
17881ChemSpider
HMDB0031198HMDB
LMFA05000625LIPID MAPS
Registry NumbersSources
CAS:3452-97-9ChemIDplus