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CHEBI:88553 - (2S)-2-Ethylhexyl acetate
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ChEBI Ontology
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ChEBI Name
(2S)-2-Ethylhexyl acetate
ChEBI ID
CHEBI:88553
Stars
This entity has been manually annotated by a third party.
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Formula
C10H20O2
Net Charge
0
Average Mass
172.265
Monoisotopic Mass
172.14633
InChI
InChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3/t10-/m0/s1
InChIKey
WOYWLLHHWAMFCB-JTQLQIEISA-N
SMILES
CCCC[C@](CC)(COC(C)=O)[H]
Metabolite of Species
Details
Homo sapiens
(NCBI:txid9606)
Found in saliva
(UBERON:0001836)
. See:
PubMed
ChEBI Ontology
Outgoing
(2S)-2-Ethylhexyl acetate (
CHEBI:88553
)
is a
acetate salt (
CHEBI:59230
)
Synonyms
Sources
(2S)-2-ethylhexyl acetate
HMDB
(2S)-2-Ethylhexyl acetic acid
HMDB
Manual Xref
Database
HMDB0061805
HMDB
View more database links
Citation
Type
Source
24421258
PubMed citation
Europe PMC