Ethanol → HCID 18456029, compound
Reaction equation
[CH3:40][CH2:41][OH:42].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([C:9]2([OH:37])[C:10]([CH3:35])([CH3:36])[O:11][c:12]3[c:13]2[c:14]([CH3:34])[c:15]([N:20]2[CH2:21][CH2:22][N:23]([c:26]4[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]4)[CH2:24][CH2:25]2)[c:16]([CH3:19])[c:17]3[CH3:18])[cH:7][cH:8]1)([F:38])[F:39]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]2[C:10]([CH3:35])([CH3:36])[O:11][c:12]3[c:13]2[c:14]([CH3:34])[c:15]([N:20]2[CH2:21][CH2:22][N:23]([c:26]4[cH:27][cH:28][c:29]([O:32][CH3:33])[cH:30][cH:31]4)[CH2:24][CH2:25]2)[c:16]([CH3:19])[c:17]3[CH3:18])[cH:7][cH:8]1)([F:38])[F:39]Participants
3
Sources & evidence
- ORD record
- ord-7e44b6b7b4ef408a8005151584f0efea
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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