1,4-Dioxane → HCID 16747772, compound
Reaction equation
[CH3:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][N:18]=[C:19]=[O:20].[CH3:1][n:2]1[c:3](=[O:11])[nH:4][c:5]2[n:6][cH:7][cH:8][cH:9][c:10]12.[O:21]1[CH2:22][CH2:23][O:24][CH2:25][CH2:26]1>>[CH3:1][n:2]1[c:3](=[O:11])[n:4]([C:19]([NH:18][CH2:17][CH2:16][CH2:15][CH2:14][CH2:13][CH3:12])=[O:20])[c:5]2[n:6][cH:7][cH:8][cH:9][c:10]12Participants
4
Sources & evidence
- ORD record
- ord-8d64775013fd45d4998c8547e5aeddf9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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