3-Isochromanone

Properties Image MNX_ID MNXM3846 reference keggC:C07728 formula C9H8O2 global charge 0 mol weight 148.161 InChIKey ILHLUZUMRJQEAH-UHFFFAOYSA-N InChI InChI=1S/C9H8O2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-4H,5-6H2 SMILES O=C1CC2=C(C=CC=C2)CO1 MNX internals InChI (mnx) InChI=1/C9H8O2/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-4H,5-6H2 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:8]2[CH2:6][O:11][C:9](=[O:10])[CH2:5][C:7]2=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0