Bromide ion → HCID 19024724, compound
Reaction equation
[Br-:10].[CH2:13]([CH:14]([CH3:15])[CH3:16])[c:17]1[cH:18][cH:19][c:20]([CH:23]([CH2:24][c:25]2[cH:26][cH:27][c:28]([C:29](=[O:30])[Cl:31])[cH:32][cH:33]2)[c:34]2[cH:35][cH:36][c:37]([CH2:40][CH:41]([CH3:42])[CH3:43])[cH:38][cH:39]2)[cH:21][cH:22]1.[CH3:11][Mg+:12].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[ClH:44].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[nH:1]1[cH:2][cH:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[nH:1]1[cH:2][c:3]([C:29]([c:28]2[cH:27][cH:26][c:25]([CH2:24][CH:23]([c:20]3[cH:19][cH:18][c:17]([CH2:13][CH:14]([CH3:15])[CH3:16])[cH:22][cH:21]3)[c:34]3[cH:35][cH:36][c:37]([CH2:40][CH:41]([CH3:42])[CH3:43])[cH:38][cH:39]3)[cH:33][cH:32]2)=[O:30])[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12Participants
8
Sources & evidence
- ORD record
- ord-5aa4aa1ee907433591ec58d5f8642a9b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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