Bromide ion → 3-Chloro-5-methyl-2,4-hexanedione
Reaction equation
[Br-:40].[CH2:20]([N+:21]([CH2:22][CH2:23][CH2:24][CH3:25])([CH2:26][CH2:27][CH2:28][CH3:29])[CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH3:36].[CH3:15][S:16]([CH3:17])=[O:18].[CH3:37][C:38]#[N:39].[CH3:41][CH2:42][CH2:43][CH2:44][N+:45]([CH2:46][CH2:47][CH2:48][CH3:49])([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57].[CH3:6][CH:7]([C:8]([CH2:9][C:10]([CH3:11])=[O:12])=[O:13])[CH3:14].[Cl:1][Si:2]([CH3:3])([CH3:4])[CH3:5].[I-:19].[OH2:58]>>[Cl:1][CH:9]([C:8]([CH:7]([CH3:6])[CH3:14])=[O:13])[C:10]([CH3:11])=[O:12]Participants
9
Sources & evidence
- ORD record
- ord-0962c54818cf471fb467652e4089f6e2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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