Acetaldehyde → HCID 178439110, compound
Reaction equation
[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[CH:40]([CH3:41])=[O:42].[Cl:43][CH:44]([Cl:45])[CH3:46].[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:37])[N:15]([CH2:19][c:20]3[c:21]([CH:30]([CH2:31][CH3:32])[NH:33][CH:34]([CH3:35])[CH3:36])[cH:22][cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:38])[F:39]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]2[CH:14]([CH3:37])[N:15]([CH2:19][c:20]3[c:21]([CH:30]([CH2:31][CH3:32])[N:33]([CH:34]([CH3:35])[CH3:36])[CH2:40][CH3:41])[cH:22][cH:23][c:24]([C:26]([F:27])([F:28])[F:29])[cH:25]3)[C:16](=[O:18])[O:17]2)[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:38])[F:39]Participants
5
Sources & evidence
- ORD record
- ord-2e6e7d408a324f73aeba51fa68410385
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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