Ethanol → HCID 21101963, compound
Reaction equation
[CH3:26][CH2:27][OH:28].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([N:12]3[CH2:13][CH2:14][NH:15][CH2:16][CH2:17]3)[cH:7][cH:8][n:9][c:10]2[cH:11]1.[N:23]#[C:24][Br:25].[Na+:22].[O-:18][C:19]([OH:20])=[O:21]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([N:12]3[CH2:13][CH2:14][N:15]([C:24]#[N:23])[CH2:16][CH2:17]3)[cH:7][cH:8][n:9][c:10]2[cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-0eba99f8cdaf434f941fa9a1ebdda39a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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