1-Butanol → HCID 15030076, compound
Reaction equation
[CH2:34]([OH:35])[CH2:36][CH2:37][CH3:38].[CH3:39][C:40]#[N:41].[Cl:16][CH2:17][CH2:18][CH:19]1[CH2:20][N:21]([CH3:25])[C:22](=[O:24])[O:23]1.[I-:33].[K+:32].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[cH:8][cH:9]1.[Na+:26].[Na+:27].[O-:28][C:29](=[O:30])[O-:31]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]2[CH2:11][CH2:12][N:13]([CH2:17][CH2:18][CH:19]3[CH2:20][N:21]([CH3:25])[C:22](=[O:24])[O:23]3)[CH2:14][CH2:15]2)[cH:8][cH:9]1Participants
9
Sources & evidence
- ORD record
- ord-fe305d1218ed4a448f734f19f922d8c5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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