Acetonitrile → HCID 68756140, compound
Reaction equation
[CH3:15][C:16]#[N:17].[CH3:1][C:2]1([CH3:14])[O:3][B:4]([c:9]2[cH:10][n:11][nH:12][cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8].[N:28]12[CH2:29][CH2:30][CH2:31][N:32]=[C:33]1[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38]2.[O:18]1[CH2:19][CH2:20][CH:21]([CH:24]=[CH:25][C:26]#[N:27])[CH2:22][CH2:23]1>>[CH3:1][C:2]1([CH3:14])[O:3][B:4]([c:9]2[cH:10][n:11][n:12]([CH:24]([CH:21]3[CH2:20][CH2:19][O:18][CH2:23][CH2:22]3)[CH2:25][C:26]#[N:27])[cH:13]2)[O:5][C:6]1([CH3:7])[CH3:8]Participants
5
Sources & evidence
- ORD record
- ord-75454c31dcf84cf8aa676ff1d1b79791
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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