3-Fluorobenzaldehyde → HCID 178471419, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][N:10]1[CH2:11][CH2:12][N:13]([C:16]([c:17]2[cH:18][c:19]([CH:23]([c:24]3[cH:25][c:26]([OH:30])[cH:27][cH:28][cH:29]3)[N:31]3[CH:32]([CH3:38])[CH2:33][NH:34][CH:35]([CH3:37])[CH2:36]3)[cH:20][cH:21][cH:22]2)=[O:39])[CH2:14][CH2:15]1)=[O:40].[F:41][c:42]1[cH:43][c:44]([CH:45]=[O:46])[cH:47][cH:48][cH:49]1>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][N:10]1[CH2:11][CH2:12][N:13]([C:16]([c:17]2[cH:18][c:19]([CH:23]([c:24]3[cH:25][c:26]([OH:30])[cH:27][cH:28][cH:29]3)[N:31]3[CH:32]([CH3:38])[CH2:33][N:34]([CH2:45][c:44]4[cH:43][c:42]([F:41])[cH:49][cH:48][cH:47]4)[CH:35]([CH3:37])[CH2:36]3)[cH:20][cH:21][cH:22]2)=[O:39])[CH2:14][CH2:15]1)=[O:40]Participants
3
Sources & evidence
- ORD record
- ord-57ca08ac22c44456b692b732636606be
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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