1-Phenyl-1,3-pentadecanedione

Properties Image MNX_ID MNXM116035 reference hmdb:HMDB0035580 formula C21H32O2 global charge 0 mol weight 316.485 InChIKey LRUAQNOCINSQGB-UHFFFAOYSA-N InChI InChI=1S/C21H32O2/c1-2-3-4-5-6-7-8-9-10-14-17-20(22)18-21(23)19-15-12-11-13-16-19/h11-13,15-16H,2-10,14,17-18H2,1H3 SMILES CCCCCCCCCCCCC(=O)CC(=O)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C21H32O2/c1-2-3-4-5-6-7-8-9-10-14-17-20(22)18-21(23)19-15-12-11-13-16-19/h11-13,15-16H,2-10,14,17-18H2,1H3 SMILES (mnx) [CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:14][CH2:17][C:20]([CH2:18][C:21]([C:19]1=[CH:15][CH:12]=[CH:11][CH:13]=[CH:16]1)=[O:23])=[O:22]

Parent-child relations graph

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