Ethanol → HCID 10207974, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][c:7]1[cH:8][c:9]([O:13][CH2:14][CH:15]=[C:16]([c:17]2[cH:18][cH:19][c:20]([Br:23])[cH:21][cH:22]2)[c:24]2[cH:25][cH:26][c:27]([Br:30])[cH:28][cH:29]2)[cH:10][cH:11][cH:12]1)=[O:31].[CH3:32][CH2:33][OH:34].[Na+:37].[OH-:36].[OH2:35]>>[O:3]=[C:4]([CH2:5][CH2:6][c:7]1[cH:8][c:9]([O:13][CH2:14][CH:15]=[C:16]([c:17]2[cH:18][cH:19][c:20]([Br:23])[cH:21][cH:22]2)[c:24]2[cH:25][cH:26][c:27]([Br:30])[cH:28][cH:29]2)[cH:10][cH:11][cH:12]1)[OH:31]Participants
6
Sources & evidence
- ORD record
- ord-336737a88150495389c3f50747224186
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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