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2-Octenyl butyrate

PropertiesImage
MNX_IDMNXM116960 Image of MNXM116960
referencechebi:171819
formulaC12H22O2
global charge0
mol weight198.306
InChIKeyGPINUUWEKPNDBB-HJWRWDBZSA-N
InChIInChI=1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8-
SMILESCCCCC/C=C\COC(=O)CCC
MNX internals
InChI (mnx)InChI=1/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8- Image of MNXM116960
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:11][O:14][C:12]([CH2:10][CH2:4][CH3:2])=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:171819
chebi:171819
GPINUUWEKPNDBB-HJWRWDBZSA-N 		2-Octenyl butyrate
[(Z)-oct-2-enyl] butanoate
hmdb:HMDB0038081
GPINUUWEKPNDBB-HJWRWDBZSA-N 		2-Octenyl butyrate
(2Z)-Oct-2-en-1-yl butanoic acid
(2Z)-oct-2-en-1-yl butanoate
(e)-2-Octenyl butanoate
(e)-Oct-2-enyl butyrate
2-Octenyl butyric acid
2-Octenyl ester(e)-butanoic acid
FEMA 3517
trans-2-Octen-1-yl butanoate
trans-2-Octen-1-yl butyrate

hmdb:HMDB38081 		secondary/obsolete/fantasy identifier