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CHEBI:132331 - citral dimethyl acetal

ChEBI IDCHEBI:132331
ChEBI Namecitral dimethyl acetal
Stars
DefinitionA monoterpenoid that is the acetal obtained by formal condensation of citral with methanol.
Last Modified18 October 2016
Submittersabrina, zfin
DownloadsMolfile
FormulaC12H22O2
Net Charge0
Average Mass198.306
Monoisotopic Mass198.16198
SMILESCOC(C=C(C)CCC=C(C)C)OC
InChIInChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3
InChIKeyZSKAJFSSXURRGL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
citral dimethyl acetal (CHEBI:132331) has functional parent citral (CHEBI:23316)
citral dimethyl acetal (CHEBI:132331) is a acetal (CHEBI:59769)
citral dimethyl acetal (CHEBI:132331) is a monoterpenoid (CHEBI:25409)
citral dimethyl acetal (CHEBI:132331) is a olefinic compound (CHEBI:78840)
IUPAC Name 
1,1-dimethoxy-3,7-dimethylocta-2,6-diene
Synonyms  Source
3,7-dimethyl-2,6-octadienal dimethyl acetalSUBMITTER
Citral dimethylacetalChemIDplus
1,1-Dimethoxy-3,7-dimethyl-2,6-octadieneChemIDplus
Manual XrefsDatabases
EP1061907Patent
WO2009063807Patent
WO9945912Patent
WO2009063931Patent
Registry NumbersSources
Reaxys:1706336Reaxys
CAS:7549-37-3ChemIDplus
CAS:7549-37-3NIST Chemistry WebBook
Citations