1-Butanol → HCID 77299967, compound
Reaction equation
[CH2:39]([OH:40])[CH2:41][CH2:42][CH3:43].[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[c:11]([N+:17](=[O:18])[O-:19])[cH:12][cH:13][c:14]([F:16])[cH:15]3)[n:7][nH:8]2)[CH2:2][CH2:3]1.[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[F:20][c:21]1[cH:22][cH:23][c:24]([CH:27]([CH3:28])[NH2:29])[cH:25][cH:26]1>>[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[c:11]([N+:17](=[O:18])[O-:19])[cH:12][cH:13][c:14]([NH:29][CH:27]([c:24]4[cH:23][cH:22][c:21]([F:20])[cH:26][cH:25]4)[CH3:28])[cH:15]3)[n:7][nH:8]2)[CH2:2][CH2:3]1Participants
5
Sources & evidence
- ORD record
- ord-9c02bc0a25a44a3e8037067615e71b44
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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