Ethanol → HCID 66752690, compound
Reaction equation
[CH2:26]([CH3:27])[O:28][CH2:29][CH2:30][O:31][c:32]1[c:33]([CH:34]=[O:35])[cH:36][cH:37][cH:38][c:39]1[O:40][CH3:41].[CH3:1][c:2]1[n:3][c:4]2[s:5][c:6]3[c:7]([n:8]2[c:9](=[O:21])[c:10]1-[c:11]1[cH:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]1)[cH:22][cH:23][cH:24][cH:25]3.[CH3:43][CH2:44][O-:45].[CH3:46][CH2:47][OH:48].[Na+:42]>>[CH:1]([c:2]1[n:3][c:4]2[s:5][c:6]3[c:7]([n:8]2[c:9](=[O:21])[c:10]1-[c:11]1[cH:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]1)[cH:22][cH:23][cH:24][cH:25]3)=[CH:34][c:33]1[c:32]([O:31][CH2:30][CH2:29][O:28][CH2:26][CH3:27])[c:39]([O:40][CH3:41])[cH:38][cH:37][cH:36]1Participants
6
Sources & evidence
- ORD record
- ord-c391a6099b914a3fa17cba4b24685727
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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