Acetone Cyanohydrin → HCID 68968606, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH:14]([c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[OH:25])[CH2:12][CH2:13]1.[CH2:65]1[O:66][CH2:67][CH2:68][CH2:69]1.[CH3:26][C:27]([C:28]#[N:29])([CH3:30])[OH:31].[O:51]=[C:52]([O:53][CH:54]([CH3:55])[CH3:56])[N:57]=[N:58][C:59]([O:60][CH:61]([CH3:62])[CH3:63])=[O:64].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([CH:14]([c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[C:28]#[N:29])[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-99fe5f09c0a3436086d8101fae31b457
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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