1-Butanol → HCID 22277869, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][N:9]([CH:10]=[O:11])[CH2:12][c:13]1[cH:14][c:15]([Cl:21])[c:16]([OH:20])[c:17]([Cl:19])[cH:18]1.[CH2:22]([CH2:23][CH2:24][CH3:25])[OH:26].[CH2:58]([Cl:59])[Cl:60].[O:46]=[C:47]([O:48][CH2:49][CH3:50])[N:51]=[N:52][C:53]([O:54][CH2:55][CH3:56])=[O:57].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][N:9]([CH:10]=[O:11])[CH2:12][c:13]1[cH:14][c:15]([Cl:21])[c:16]([O:20][CH2:22][CH2:23][CH2:24][CH3:25])[c:17]([Cl:19])[cH:18]1Participants
6
Sources & evidence
- ORD record
- ord-1e225843578546de920916758c06bd98
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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