Benzene → HCID 12412185, compound
Reaction equation
[BH4-:19].[CH3:27][OH:28].[Na+:20].[c:1]1(-[c:7]2[c:8]([CH2:16][C:17]#[N:18])[c:9]3[c:10]([s:11]2)[cH:12][cH:13][cH:14][cH:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[c:1]1(-[c:7]2[c:8]([CH2:16][CH2:17][NH2:18])[c:9]3[c:10]([s:11]2)[cH:12][cH:13][cH:14][cH:15]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
6
Sources & evidence
- ORD record
- ord-b4b65ec1cdbf4f4b853650e2b6400137
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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