Ethanol → HCID 11202571, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]([CH3:36])[cH:11][c:12]([O:15][CH2:16][c:17]2[c:18]([CH:33]3[CH2:34][CH2:35]3)[n:19][c:20](-[c:23]3[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)[n:21][cH:22]2)[cH:13][cH:14]1)=[O:37].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH3:45][CH2:46][OH:47].[Na+:39].[OH-:38]>>[O:3]=[C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]([CH3:36])[cH:11][c:12]([O:15][CH2:16][c:17]2[c:18]([CH:33]3[CH2:34][CH2:35]3)[n:19][c:20](-[c:23]3[cH:24][c:25]([C:29]([F:30])([F:31])[F:32])[cH:26][cH:27][cH:28]3)[n:21][cH:22]2)[cH:13][cH:14]1)[OH:37]Participants
6
Sources & evidence
- ORD record
- ord-6b946b3d22664c7db83325423fd17f51
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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