Ethanol → HCID 20532902, compound
Reaction equation
[C:1]([CH2:2][CH2:3][C:4]([O:6][CH2:5][CH3:7])=[O:8])(=[O:9])[O:10][CH2:11][CH3:12].[CH3:13][c:14]1[c:15]([CH2:16][C:17]#[N:18])[cH:19][cH:20][c:21]([CH3:23])[cH:22]1.[CH3:25][CH2:26][OH:27].[Na:24]>>[C:1]([CH2:2][CH2:3][C:4](=[O:6])[CH:16]([c:15]1[c:14]([CH3:13])[cH:22][c:21]([CH3:23])[cH:20][cH:19]1)[C:17]#[N:18])(=[O:9])[O:10][CH2:11][CH3:12]Participants
5
Sources & evidence
- ORD record
- ord-0a1a35f72fa44ddfacc7bbb7481ca390
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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