Benzene → N-[(3-ethenylphenyl)methyl]-N,6,6-trimethylhept-2-en-4-yn-1-amine
Reaction equation
[Br-:32].[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:12][C:13]([C:14]#[C:15][CH:16]=[CH:17][CH2:18][N:19]([CH3:20])[CH2:21][c:22]1[cH:23][c:24]([CH:25]=[O:26])[cH:27][cH:28][cH:29]1)([CH3:30])[CH3:31].[CH3:33][P+:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)([c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:6][CH2:7][CH2:8][CH2:9][CH2:10][CH3:11].[cH:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[CH2:1]=[CH:25][c:24]1[cH:23][c:22]([CH2:21][N:19]([CH2:18][CH:17]=[CH:16][C:15]#[C:14][C:13]([CH3:12])([CH3:30])[CH3:31])[CH3:20])[cH:29][cH:28][cH:27]1Participants
7
Sources & evidence
- ORD record
- ord-c0da388c2606478f911cfb73a606d98e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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