3-Phenylbutanal

Properties Image MNX_ID MNXM819687 reference sabiorkM:30077 formula C10H12O global charge 0 mol weight 148.205 InChIKey MYHGOWDLVRDUFA-UHFFFAOYSA-N InChI InChI=1S/C10H12O/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3 SMILES CC(CC=O)C1=CC=CC=C1 MNX internals InChI (mnx) InChI=1/C10H12O/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3/t9? SMILES (mnx) [CH3:1][CH:9]([CH2:7][CH:8]=[O:11])[C:10]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1

Parent-child relations graph

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