3-methylundecanoate

Properties Image MNX_ID MNXM26001 reference chebi:84184 formula C12H23O2 global charge -1 mol weight 199.314 InChIKey SHTJBHFHMAKAPT-UHFFFAOYSA-M InChI InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-11(2)10-12(13)14/h11H,3-10H2,1-2H3,(H,13,14)/p-1 SMILES CCCCCCCCC(C)CC(=O)[O-] MNX internals InChI (mnx) InChI=1/C12H24O2/c1-3-4-5-6-7-8-9-11(2)10-12(13)14/h11H,3-10H2,1-2H3,(H,13,14)/t11? SMILES (mnx) [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH:11]([CH3:2])[CH2:10][C:12](=[O:13])[OH:14]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1