Acetic Acid → HCID 173183392, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:19][SiH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[N:7]([c:9]2[s:10][cH:11][c:12]([C:14]([O:16][CH2:15][CH3:17])=[O:18])[n:13]2)[CH2:8]1.[CH3:33][Al:34]([CH3:35])[CH3:36].[CH3:39][C:40](=[O:41])[OH:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl-:37].[NH4+:38].[cH:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH:6]([O:19][SiH:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[N:7]([c:9]2[s:10][cH:11][c:12]([C:14](=[O:16])[NH2:38])[n:13]2)[CH2:8]1Participants
8
Sources & evidence
- ORD record
- ord-9b9d608c4b84457da025b5d4a36dac58
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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