Acetone → HCID 14986442, compound
Reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][c:8]1[c:9]([O:20][CH3:21])[c:10]([O:18][CH3:19])[c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[cH:12][cH:13]1.[C:43](=[O:44])([O-:45])[O-:46].[CH3:51][C:52](=[O:53])[CH3:54].[CH3:55][N:56]([CH3:57])[CH:58]=[O:59].[I-:50].[K+:47].[K+:48].[Na+:49].[c:22]1([CH2:28][O:29][C:30]([c:31]2[c:32]([OH:41])[c:33]([CH2:38][CH2:39][CH3:40])[c:34]([OH:37])[cH:35][cH:36]2)=[O:42])[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][c:8]1[c:9]([O:20][CH3:21])[c:10]([O:18][CH3:19])[c:11]([C:14]([CH3:15])([CH3:16])[CH3:17])[cH:12][cH:13]1)[O:37][c:34]1[c:33]([CH2:38][CH2:39][CH3:40])[c:32]([OH:41])[c:31]([C:30]([O:29][CH2:28][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)=[O:42])[cH:36][cH:35]1Participants
9
Sources & evidence
- ORD record
- ord-67df50c094b24c969c1086c4c2b056b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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