Ethanol → HCID 67290361, compound
Reaction equation
[CH2:25]([OH:26])[CH3:27].[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[NH:8][CH:7]([c:12]1[cH:13][c:14]([N+:18]([O-:19])=[O:20])[cH:15][cH:16][cH:17]1)[CH2:6][C:5]2([CH3:21])[CH3:22].[Fe:23].[OH2:24]>>[Cl:1][c:2]1[cH:3][c:4]2[c:9]([cH:10][cH:11]1)[NH:8][CH:7]([c:12]1[cH:13][c:14]([NH2:18])[cH:15][cH:16][cH:17]1)[CH2:6][C:5]2([CH3:21])[CH3:22]Participants
5
Sources & evidence
- ORD record
- ord-7dfe962a78dd40938092ae292b22050f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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