Toluene → HCID 12990116, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[C:9]1([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2-[c:16]2[cH:17][cH:18][c:19]([Br:22])[cH:20][c:21]21.[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH3:38][CH2:39][CH2:40][CH2:41][Li:42].[CH3:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[C:9]1([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[c:10]2[cH:11][cH:12][cH:13][cH:14][c:15]2-[c:16]2[cH:17][cH:18][c:19]([CH:44]=[O:43])[cH:20][c:21]21Participants
6
Sources & evidence
- ORD record
- ord-953c18e81d9d48fc8a45ad8991f3cd19
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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