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Dodecyl butyrate

PropertiesImage
MNX_IDMNXM100388 Image of MNXM100388
referencechebi:174367
formulaC16H32O2
global charge0
mol weight256.43
InChIKeyJEPXJYKYHMEESP-UHFFFAOYSA-N
InChIInChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-15-18-16(17)14-4-2/h3-15H2,1-2H3
SMILESCCCCCCCCCCCCOC(=O)CCC
MNX internals
InChI (mnx)InChI=1/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-15-18-16(17)14-4-2/h3-15H2,1-2H3 Image of MNXM100388
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:15][O:18][C:16]([CH2:14][CH2:4][CH3:2])=[O:17]
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:174367
chebi:174367
JEPXJYKYHMEESP-UHFFFAOYSA-N
Dodecyl butyrate
dodecyl butanoate
hmdb:HMDB0032249
JEPXJYKYHMEESP-UHFFFAOYSA-N
Dodecyl butyrate
1-Dodecanol, butanoate
Butanoic acid, dodecyl ester
Butyric acid, dodecyl ester
Dodecyl butyric acid
dodecyl butanoate

lipidmaps:LMFA07010424
lipidmapsM:LMFA07010424
JEPXJYKYHMEESP-UHFFFAOYSA-N
SFE 12:0/4:0
SFE 16:0
WE(12:0/4:0)
dodecyl butyrate

hmdb:HMDB32249
secondary/obsolete/fantasy identifier