1-Phenyl-1,3-dodecanedione

Properties Image MNX_ID MNXM116028 reference hmdb:HMDB0035579 formula C18H26O2 global charge 0 mol weight 274.404 InChIKey DNOUOXHKVWWDSS-UHFFFAOYSA-N InChI InChI=1S/C18H26O2/c1-2-3-4-5-6-7-11-14-17(19)15-18(20)16-12-9-8-10-13-16/h8-10,12-13H,2-7,11,14-15H2,1H3 SMILES CCCCCCCCCC(=O)CC(=O)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C18H26O2/c1-2-3-4-5-6-7-11-14-17(19)15-18(20)16-12-9-8-10-13-16/h8-10,12-13H,2-7,11,14-15H2,1H3 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:11][CH2:14][C:17]([CH2:15][C:18]([C:16]1=[CH:12][CH:9]=[CH:8][CH:10]=[CH:13]1)=[O:20])=[O:19]

Parent-child relations graph

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