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Isobutyl 2-furanpropionate

PropertiesImage
MNX_IDMNXM126799 Image of MNXM126799
referencechebi:169336
formulaC11H16O3
global charge0
mol weight196.246
InChIKeySVDPTFHRRNUNRS-UHFFFAOYSA-N
InChIInChI=1S/C11H16O3/c1-9(2)8-14-11(12)6-5-10-4-3-7-13-10/h3-4,7,9H,5-6,8H2,1-2H3
SMILESCC(C)COC(=O)CCC1=CC=CO1
MNX internals
InChI (mnx)InChI=1/C11H16O3/c1-9(2)8-14-11(12)6-5-10-4-3-7-13-10/h3-4,7,9H,5-6,8H2,1-2H3 Image of MNXM126799
SMILES (mnx)[CH3:1][CH:9]([CH3:2])[CH2:8][O:14][C:11]([CH2:6][CH2:5][C:10]1=[CH:4][CH:3]=[CH:7][O:13]1)=[O:12]
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:169336
chebi:169336
SVDPTFHRRNUNRS-UHFFFAOYSA-N
Isobutyl 2-furanpropionate
2-methylpropyl 3-(uran-2-yl)propanoate
hmdb:HMDB0037734
SVDPTFHRRNUNRS-UHFFFAOYSA-N
Isobutyl 2-furanpropionate
2-methylpropyl 3-(furan-2-yl)propanoate
FEMA 2198
Isobutyl 2-furanpropionic acid

lipidmaps:LMFA07010915
lipidmapsM:LMFA07010915
SVDPTFHRRNUNRS-UHFFFAOYSA-N
Isobutyl 2-furanpropionate
2-methylpropyl 3-(furan-2-yl)propanoate
O
WE 11:3

hmdb:HMDB37734
secondary/obsolete/fantasy identifier