3-oxo-3-phenylpropanoate

Properties Image MNX_ID MNXM3171 reference chebi:22731 formula C9H7O3 global charge -1 mol weight 163.152 InChIKey HXUIDZOMTRMIOE-UHFFFAOYSA-M InChI InChI=1S/C9H8O3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)/p-1 SMILES O=C([O-])CC(=O)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C9H8O3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12) SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:7]([C:8]([CH2:6][C:9](=[O:11])[OH:12])=[O:10])[CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 7 in models (compartimentalized) 1