Acetone → HCID 19004331, compound
Reaction equation
[CH3:1][O:2][C:3]([C:4]([c:5]1[cH:6][cH:7][c:8]([O:11][CH2:12][CH2:13][O:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[cH:23][c:24]2[O:25][CH2:26][CH2:27][O:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:9][cH:10]1)=[O:35])=[O:36].[CH3:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44].[CH3:45][C:46]([CH3:47])=[O:48].[CH3:49][OH:50].[Na+:38].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[OH-:37].[OH2:56]>>[O:2]=[C:3]([C:4]([c:5]1[cH:6][cH:7][c:8]([O:11][CH2:12][CH2:13][O:14][c:15]2[cH:16][c:17]3[cH:18][cH:19][cH:20][cH:21][c:22]3[cH:23][c:24]2[O:25][CH2:26][CH2:27][O:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[cH:9][cH:10]1)=[O:35])[OH:36]Participants
9
Sources & evidence
- ORD record
- ord-b84ec48a210d4f699389363648421d70
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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