Beta-Alanine → 2-[2-Phenylethoxy]ethylidene propanedinitrile
Reaction equation
[CH3:24][CH2:25][OH:26].[N:19]#[C:20][CH2:21][C:22]#[N:23].[NH2:1][CH2:2][CH2:3][C:4]([OH:5])=[O:6].[c:7]1([CH2:13][CH2:14][O:15][CH2:16][CH:17]=[O:18])[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[c:7]1([CH2:13][CH2:14][O:15][CH2:16][CH:17]=[C:21]([C:20]#[N:19])[C:22]#[N:23])[cH:8][cH:9][cH:10][cH:11][cH:12]1Participants
5
Sources & evidence
- ORD record
- ord-8a89f9b69fbe45d9acfedf5a2dddbe6e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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