Ethanol → HCID 59016038, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([O:7][c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][c:16]2[n:17][n:18](-[c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[c:19](=[O:24])[n:20]2[CH2:21][CH2:22][CH3:23])[cH:12][cH:13]1)[CH3:35])=[O:36].[CH3:39][CH2:40][OH:41].[Na+:38].[OH-:37]>>[O:3]=[C:4]([C:5]([CH3:6])([O:7][c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:15][c:16]2[n:17][n:18](-[c:25]3[cH:26][cH:27][c:28]([C:31]([F:32])([F:33])[F:34])[cH:29][cH:30]3)[c:19](=[O:24])[n:20]2[CH2:21][CH2:22][CH3:23])[cH:12][cH:13]1)[CH3:35])[OH:36]Participants
5
Sources & evidence
- ORD record
- ord-317a6a095cf6438ba5cf6204ecc2ab2e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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