Ethanol → HCID 56971147, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH2:6][CH2:7][CH2:8][CH:9]([N:10]1[CH2:11][c:12]2[c:13]([s:16][cH:17][cH:18]2)[CH2:14][CH2:15]1)[c:19]1[c:20]([Cl:25])[cH:21][cH:22][cH:23][cH:24]1)([CH3:26])[CH3:27])=[O:28].[CH3:29][CH2:30][OH:31].[Na+:33].[OH-:32].[OH2:34]>>[O:3]=[C:4]([C:5]([CH2:6][CH2:7][CH2:8][CH:9]([N:10]1[CH2:11][c:12]2[c:13]([s:16][cH:17][cH:18]2)[CH2:14][CH2:15]1)[c:19]1[c:20]([Cl:25])[cH:21][cH:22][cH:23][cH:24]1)([CH3:26])[CH3:27])[OH:28]Participants
6
Sources & evidence
- ORD record
- ord-f948be91774f462aba371f8853e733d9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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