Acetic Acid → HCID 22353182, compound
Reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[Na+:29].[OH-:28].[OH2:27].[OH:23][N+:24]([O-:25])=[O:26].[c:1]1(-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:2]([O:7][CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][CH2:13][O:14][CH2:15][CH2:16]2)[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:2]([O:7][CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][CH2:13][O:14][CH2:15][CH2:16]2)[cH:3][cH:4][c:5]([N+:24](=[O:23])[O-:25])[cH:6]1Participants
7
Sources & evidence
- ORD record
- ord-08c2154b2a374b2c9e8734a8f2b9e81d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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