Diethyl Ether → HCID 23526874, compound
Reaction equation
[C:32]([O:33][CH2:34][CH3:35])(=[O:36])[CH3:37].[CH2:38]([O:39][CH2:40][CH3:41])[CH3:42].[CH3:43][CH2:44][O:45][CH2:46][CH3:47].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:21]3[n:22][c:23]([S:27][CH3:28])[n:24][cH:25][cH:26]3)[n:10]3[n:11]([c:19]2=[O:20])[CH2:12][CH2:13][CH2:14][CH:15]3[C:16](=[O:17])[OH:18])[cH:6][cH:7]1.[N+:29](=[N-:30])=[CH2:31]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9](-[c:21]3[n:22][c:23]([S:27][CH3:28])[n:24][cH:25][cH:26]3)[n:10]3[n:11]([c:19]2=[O:20])[CH2:12][CH2:13][CH2:14][CH:15]3[C:16]([O:17][CH3:31])=[O:18])[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-e0f38aed61d84ccfbac0cef94a8890ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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