Acetic Acid → HCID 54453104, compound
Reaction equation
[CH2:12]([CH3:13])[c:14]1[n:15][n:16][c:17]([CH3:19])[s:18]1.[CH3:1][n:2]1[c:3]([CH:10]=[O:11])[n:4][cH:5][c:6]1[N+:7](=[O:8])[O-:9].[CH3:20][C:21](=[O:22])[OH:23].[CH3:24][C:25]([O:26][C:27](=[O:28])[CH3:29])=[O:30]>>[CH3:1][n:2]1[c:3]([CH:10]=[CH:19][c:17]2[n:16][n:15][c:14]([CH2:12][CH3:13])[s:18]2)[n:4][cH:5][c:6]1[N+:7](=[O:8])[O-:9]Participants
5
Sources & evidence
- ORD record
- ord-fbb5f281593945d9ba31d43baafa3152
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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