3-Methylbutanal → HCID 69156456, compound
Reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([NH2:23])[c:7](=[O:22])[c:8]2[cH:9][cH:10][c:11]([Cl:21])[cH:12][c:13]2[c:14]1-[c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[CH:24]([CH2:25][CH:26]([CH3:27])[CH3:28])=[O:29]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6]([N:23]=[CH:24][CH2:25][CH:26]([CH3:27])[CH3:28])[c:7](=[O:22])[c:8]2[cH:9][cH:10][c:11]([Cl:21])[cH:12][c:13]2[c:14]1-[c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1Participants
3
Sources & evidence
- ORD record
- ord-a871d40e49d54a5eb8b9d7c22e48aeb8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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