tert-Butanol → HCID 57749238, compound
Reaction equation
[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][C:45]([OH:46])([CH3:47])[CH3:48].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([O:7][c:8]2[cH:9][cH:10][c:11]([C:14]([OH:15])=[O:16])[n:12][cH:13]2)[cH:17][cH:18][cH:19]1.[c:20]1([P:21]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)(=[O:30])[N:34]=[N+:22]=[N-:23])[cH:31][cH:32][cH:33][cH:35][cH:36]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([O:7][c:8]2[cH:9][cH:10][c:11]([NH2:34])[n:12][cH:13]2)[cH:17][cH:18][cH:19]1Participants
5
Sources & evidence
- ORD record
- ord-8df3d41713f647ad94ed03c2b4182da0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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