Ethanol → HCID 21069869, compound
Reaction equation
[CH3:15][CH2:16][N:17]([CH2:18][CH3:19])[CH2:20][CH3:21].[CH3:34][CH2:35][OH:36].[Cl:22][O:23][C:24]([CH3:25])([CH3:26])[CH3:27].[Na+:32].[Na+:33].[S:28]([O-:29])([O-:30])=[O:31].[c:1]1([CH3:14])[cH:2][c:3]([C:7]2([C:10]([F:11])([F:12])[F:13])[NH:8][NH:9]2)[cH:4][cH:5][cH:6]1>>[c:1]1([CH3:14])[cH:2][c:3]([C:7]2([C:10]([F:11])([F:12])[F:13])[N:8]=[N:9]2)[cH:4][cH:5][cH:6]1Participants
7
Sources & evidence
- ORD record
- ord-1d82dc415d8d44b785e9309a43a739c3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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