Bromide ion → HCID 86638728, compound
Reaction equation
[Br-:38].[CH3:39][CH2:40][CH2:41][CH2:42][N+:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55].[Cl:56][CH2:57][Cl:58].[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[OH:7])[cH:8][cH:9][c:10]1-[c:11]1[s:12][c:13]2[n:14][c:15]([C:20]3([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[CH2:21][CH2:22]3)[cH:16][cH:17][c:18]2[n:19]1.[N-:31]=[N+:32]=[N-:33].[Na+:30].[OH2:29].[S:34]([Cl:35])([Cl:36])=[O:37]>>[F:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[N:31]=[N+:32]=[N-:33])[cH:8][cH:9][c:10]1-[c:11]1[s:12][c:13]2[n:14][c:15]([C:20]3([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[CH2:21][CH2:22]3)[cH:16][cH:17][c:18]2[n:19]1Participants
9
Sources & evidence
- ORD record
- ord-eba9c5dc8436456e8124821d1902a89a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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