Hydrochloric Acid → 1(3H)-Isobenzofuranone,3-hydroxy-5-methyl-(9CI)
Reaction equation
[C:17]([O:18][CH2:20][CH3:21])(=[O:19])[CH3:22].[CH2:1]([N:2]([CH2:3][CH3:15])[C:4]([c:5]1[c:6]([CH:12]=[O:13])[cH:7][c:8]([CH3:11])[cH:9][cH:10]1)=[O:14])[CH3:16].[CH3:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28].[ClH:29].[OH2:30]>>[C:4]1(=[O:14])[c:5]2[c:6]([cH:7][c:8]([CH3:11])[cH:9][cH:10]2)[CH:12]([OH:19])[O:13]1Participants
6
Sources & evidence
- ORD record
- ord-a84357457f004613adeb795eb21fe4d8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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