Acetic Acid → HCID 13606797, compound
Reaction equation
[CH3:1][c:2]1[cH:3][n:4]2[c:5]([c:6]3[cH:7][c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][c:11]13)[n:15][cH:16][c:17]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[c:18]2=[O:19].[CH3:25][C:26](=[O:27])[OH:28].[ClH:29]>>[CH3:1][c:2]1[cH:3][n:4]2[c:5]([c:6]3[cH:7][c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][c:11]13)[n:15][cH:16][c:17]([C:20](=[O:21])[OH:22])[c:18]2=[O:19]Participants
4
Sources & evidence
- ORD record
- ord-1fe2a27f2e7244b597a837d2bdb2981a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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