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CHEBI:34711 - Diisopropyl adipate

ChEBI IDCHEBI:34711
ChEBI NameDiisopropyl adipate
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC12H22O4
Net Charge0
Average Mass230.304
Monoisotopic Mass230.15181
SMILESCC(C)OC(=O)CCCCC(=O)OC(C)C
InChIInChI=1S/C12H22O4/c1-9(2)15-11(13)7-5-6-8-12(14)16-10(3)4/h9-10H,5-8H2,1-4H3
InChIKeyZDQWESQEGGJUCH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Diisopropyl adipate (CHEBI:34711) is a fatty acid ester (CHEBI:35748)
Diisopropyl adipate (CHEBI:34711) is a isopropyl ester (CHEBI:35725)
Synonym  Source
Diisopropyl adipateKEGG COMPOUND
Manual XrefsDatabases
C14523KEGG COMPOUND
HMDB0041613HMDB
Registry NumbersSources
CAS:6938-94-9KEGG COMPOUND