Ethanol → HCID 54080304, compound
Reaction equation
[CH3:22][O-:23].[CH3:26][CH2:27][OH:28].[Na+:24].[OH2:25].[n:13]1[cH:14][c:15]([CH2:19][C:20]#[N:21])[cH:16][cH:17][cH:18]1.[n:1]1[cH:2][cH:3][c:4]([CH:11]=[O:12])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[n:1]1[cH:2][cH:3][c:4]([CH:11]=[C:19]([c:15]2[cH:14][n:13][cH:18][cH:17][cH:16]2)[C:20]#[N:21])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12Participants
7
Sources & evidence
- ORD record
- ord-ac25f7742e7c485c9814e27642c6dc6d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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