(+-)-2-(4'-isobutylphenyl)propionitrile

Properties Image MNX_ID MNXM30186 reference chebi:27415 formula C13H17N global charge 0 mol weight 187.286 InChIKey PKQKHWNHCKNYSW-UHFFFAOYSA-N InChI InChI=1S/C13H17N/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,10-11H,8H2,1-3H3 SMILES CC(C)CC1=CC=C(C(C)C#N)C=C1 MNX internals InChI (mnx) InChI=1/C13H17N/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,10-11H,8H2,1-3H3/t11? SMILES (mnx) [CH3:1][CH:10]([CH3:2])[CH2:8][C:12]1=[CH:5][CH:7]=[C:13]([CH:11]([CH3:3])[C:9]#[N:14])[CH:6]=[CH:4]1

Parent-child relations graph

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