Acetone → 6-Cyano-4-chromanone
Reaction equation
[C-:39]#[N:40].[CH3:42][C:43]#[N:44].[CH3:47][C:48](=[O:49])[CH3:50].[CH3:51][CH2:52][O:53][CH2:54][CH3:55].[ClH:45].[F:1][C:2]([F:3])([F:4])[S:5]([O:6][c:7]1[cH:8][cH:9][c:10]2[c:15]([cH:16]1)[O:14][CH2:13][CH2:12][C:11]2=[O:17])(=[O:18])=[O:19].[K+:41].[OH2:46].[Zn:56].[c:20]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[c:7]1([C:39]#[N:40])[cH:8][cH:9][c:10]2[c:15]([cH:16]1)[O:14][CH2:13][CH2:12][C:11]2=[O:17]Participants
11
Reactant 10
Product 1
Sources & evidence
- ORD record
- ord-f951dcd118c64d9bb1f76bc75cac450f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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