Ethanol → HCID 54292959, compound
Reaction equation
[CH3:22][O-:23].[CH3:25][CH2:26][OH:27].[Na+:24].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH:11]=[O:12])[cH:10]2.[n:13]1[cH:14][c:15]([CH2:19][C:20]#[N:21])[cH:16][cH:17][cH:18]1>>[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH:11]=[C:19]([c:15]1[cH:14][n:13][cH:18][cH:17][cH:16]1)[C:20]#[N:21])[cH:10]2Participants
6
Sources & evidence
- ORD record
- ord-e4d8401c3453482f8b6dba0da0acdd05
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…