3-Methylbutanal → HCID 57666616, compound
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]([CH3:7])[CH3:8])[c:9]1[cH:10][c:11](-[c:27]2[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]2)[cH:12][c:13]([NH:15][CH2:16][c:17]2[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]2)[cH:14]1)=[O:37].[CH:38]([CH2:39][CH:40]([CH3:41])[CH3:42])=[O:43]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH:6]([CH3:7])[CH3:8])[c:9]1[cH:10][c:11](-[c:27]2[cH:28][cH:29][c:30]([C:33]([F:34])([F:35])[F:36])[cH:31][cH:32]2)[cH:12][c:13]([N:15]([CH2:16][c:17]2[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]2)[CH2:38][CH2:39][CH:40]([CH3:41])[CH3:42])[cH:14]1)=[O:37]Participants
3
Sources & evidence
- ORD record
- ord-1b01ab95b95543ce8731c88c95d79f58
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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