Acetonitrile → HCID 44409596, compound
Reaction equation
[CH3:16][c:17]1[nH:18][c:19]2[cH:20][cH:21][c:22]([OH:26])[cH:23][c:24]2[cH:25]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH3:15])[c:7]2[c:8]([Cl:14])[n:9][cH:10][n:11][n:12]2[cH:13]1.[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:34][C:35]#[N:36]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[c:6]([CH3:15])[c:7]2[c:8]([O:26][c:22]3[cH:21][cH:20][c:19]4[nH:18][c:17]([CH3:16])[cH:25][c:24]4[cH:23]3)[n:9][cH:10][n:11][n:12]2[cH:13]1Participants
5
Sources & evidence
- ORD record
- ord-6939f27e6a634d6894f0c689369d1c1d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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