Ethanol → HCID 21878474, compound
Reaction equation
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:28][CH2:29][OH:30].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[Na+:27].[OH-:26].[OH2:21].[OH2:22].[Sn:23]([Cl:24])[Cl:25].[n:1]1[cH:2][nH:3][c:4]([CH2:6][CH2:7][NH:8][c:9]2[s:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][c:16]([N+:18]([O-:19])=[O:20])[cH:17]3)[cH:5]1>>[n:1]1[cH:2][nH:3][c:4]([CH2:6][CH2:7][NH:8][c:9]2[s:10][c:11]3[c:12]([n:13]2)[cH:14][cH:15][c:16]([NH2:18])[cH:17]3)[cH:5]1Participants
9
Sources & evidence
- ORD record
- ord-4573414ccd014eeab47f3f056f2d2424
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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