Acetic Acid → HCID 68704279, compound
Reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[OH:1][c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]([CH:8]=[C:9]([C:10]#[N:11])[c:12]2[cH:13][n:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:6][cH:7]1.[OH:24][N+:25]([O-:26])=[O:27]>>[OH:1][c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]([CH:8]=[C:9]([C:10]#[N:11])[c:12]2[cH:13][n:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]2)[cH:6][c:7]1[N+:25](=[O:24])[O-:26]Participants
4
Sources & evidence
- ORD record
- ord-7527e5b631f14da89001a2c5aabcbbcd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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