Acetonitrile → HCID 24823497, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][P:4]([O:5][CH2:6][CH3:7])(=[O:8])[C:9]([c:10]1[cH:11][c:12]([N:16]([C:17](=[O:18])[c:19]2[cH:20][cH:21][c:22](-[c:25]3[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:29][cH:30]3)[cH:23][cH:24]2)[CH3:40])[cH:13][cH:14][cH:15]1)([F:41])[F:42].[CH2:43]1[N:44]2[CH2:45][CH2:46][N:47]([CH2:48][CH2:49]2)[CH2:50]1.[CH3:51][C:52]#[N:53]>>[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([OH:8])[C:9]([c:10]1[cH:11][c:12]([N:16]([C:17](=[O:18])[c:19]2[cH:20][cH:21][c:22](-[c:25]3[cH:26][cH:27][c:28]([O:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:29][cH:30]3)[cH:23][cH:24]2)[CH3:40])[cH:13][cH:14][cH:15]1)([F:41])[F:42]Participants
4
Sources & evidence
- ORD record
- ord-ea0b1f6aa2864735b53a6291e3d1ac62
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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