Ethanol → HCID 178441775, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][c:8]([CH2:32][CH2:33][CH2:34][CH3:35])[n:9]([CH:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17](-[c:21]4[c:22](-[c:27]5[n:28][n:29][n:30][nH:31]5)[cH:23][cH:24][cH:25][cH:26]4)[cH:18][cH:19][c:20]32)[c:10]1[Cl:11].[CH3:38][CH2:39][OH:40].[Na+:37].[OH-:36]>>[O:3]=[C:4]([OH:5])[c:6]1[n:7][c:8]([CH2:32][CH2:33][CH2:34][CH3:35])[n:9]([CH:12]2[CH2:13][CH2:14][c:15]3[cH:16][c:17](-[c:21]4[c:22](-[c:27]5[n:28][n:29][n:30][nH:31]5)[cH:23][cH:24][cH:25][cH:26]4)[cH:18][cH:19][c:20]32)[c:10]1[Cl:11]Participants
5
Sources & evidence
- ORD record
- ord-94ee3265211344cf962db4b033b02654
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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