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CHEBI:217209 - 2-methylbutyl pentanoate

ChEBI IDCHEBI:217209
ChEBI Name2-methylbutyl pentanoate
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILESCCCCC(=O)OC[C@@H](C)CC
InChIInChI=1S/C10H20O2/c1-4-6-7-10(11)12-8-9(3)5-2/h9H,4-8H2,1-3H3/t9-/m0/s1
InChIKeyFOJKZJAPKUOYKR-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Aspergillus clavatus NRRL 1 (ncbitaxon:344612) - PubMed (29765471)
ChEBI Ontology
Outgoing Relation(s)
2-methylbutyl pentanoate (CHEBI:217209) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
2-methylbutyl pentanoate
Manual XrefsDatabases
455050ChemSpider