Acetonitrile → Bromide ion
Reaction equation
[C:6]([CH3:7])(=[O:8])[O:9][CH:10]1[CH2:11][CH:12]2[CH2:13][CH2:14][CH:15]3[CH:16]4[CH2:17][CH:18]([N:39]5[CH2:40][CH2:41][CH2:42][CH2:43]5)[CH:19]([O:35][C:36]([CH3:37])=[O:38])[C:20]4([CH3:21])[CH2:22][CH2:23][CH:24]3[C:25]2([CH3:34])[CH2:26][CH:27]1[N:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1.[CH3:44][C:45]#[N:46].[CH:1]1([CH2:4][Br:5])[CH2:2][CH2:3]1>>[Br-:5].[CH:1]1([CH2:4][N+:39]2([CH:18]3[CH2:17][CH:16]4[CH:15]5[CH2:14][CH2:13][CH:12]6[CH2:11][CH:10]([O:9][C:6]([CH3:7])=[O:8])[CH:27]([N:28]7[CH2:29][CH2:30][O:31][CH2:32][CH2:33]7)[CH2:26][C:25]6([CH3:34])[CH:24]5[CH2:23][CH2:22][C:20]4([CH3:21])[CH:19]3[O:35][C:36]([CH3:37])=[O:38])[CH2:40][CH2:41][CH2:42][CH2:43]2)[CH2:2][CH2:3]1Participants
5
Sources & evidence
- ORD record
- ord-54624907fb834d78b79e8ed01c24d0ce
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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