1,4-Dioxane → HCID 69235848, compound
Reaction equation
[CH3:1][c:2]1[n:3][c:4]2[cH:5][c:6]3[c:7]([cH:8][c:9]2[c:10]([O:12][c:13]2[cH:14][cH:15][c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]2)[cH:11]1)[O:22][CH2:23][O:24]3.[O:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1>>[CH3:1][c:2]1[n:3][c:4]2[cH:5][c:6]3[c:7]([cH:8][c:9]2[c:10]([O:12][c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[cH:11]1)[O:22][CH2:23][O:24]3Participants
3
Sources & evidence
- ORD record
- ord-5766cc8bd4b140e4836ad3df9192a9bd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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