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CHEBI:88553 - (2S)-2-Ethylhexyl acetate

ChEBI IDCHEBI:88553
ChEBI Name(2S)-2-Ethylhexyl acetate
Stars
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILES[H][C@](CC)(CCCC)COC(C)=O
InChIInChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3/t10-/m0/s1
InChIKeyWOYWLLHHWAMFCB-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) PubMed (24421258)
ChEBI Ontology
Outgoing Relation(s)
(2S)-2-Ethylhexyl acetate (CHEBI:88553) is a acetate salt (CHEBI:59230)
Synonyms  Source
(2S)-2-ethylhexyl acetateHMDB
(2S)-2-Ethylhexyl acetic acidHMDB
Manual XrefsDatabases
HMDB0061805HMDB
Citations