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CHEBI:179547 - Acetaldehyde 1,3-octanediol acetal

ChEBI IDCHEBI:179547
ChEBI NameAcetaldehyde 1,3-octanediol acetal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILESCCCCCC1CCOC(C)O1
InChIInChI=1S/C10H20O2/c1-3-4-5-6-10-7-8-11-9(2)12-10/h9-10H,3-8H2,1-2H3
InChIKeyNZTUUEJEMACERX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Acetaldehyde 1,3-octanediol acetal (CHEBI:179547) is a dioxanes (CHEBI:46926)
IUPAC Name 
2-methyl-4-pentyl-1,3-dioxane
Manual XrefsDatabases
HMDB0032155HMDB
9280962ChemSpider
Registry NumbersSources
CAS:202188-43-0ChemIDplus