Isopropanol → HCID 178507988, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]([CH2:11][OH:12])[NH:13][c:14]1[c:15]([N+:24]([O-:25])=[O:26])[cH:16][n:17][c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]12.[CH3:27][C:28]#[N:29].[CH:30]([OH:31])([CH3:32])[CH3:33]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH2:9][CH:10]([CH2:11][OH:12])[NH:13][c:14]1[c:15]([NH2:24])[cH:16][n:17][c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]12Participants
4
Sources & evidence
- ORD record
- ord-d08e08a7f16341fbba21cc10446ddfae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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