Acetonitrile → HCID 22462878, compound

HRID 688970Notes

Reaction equation

HRID 688970 reaction equation
[Br:12][CH2:13][CH2:14][CH:15]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[NH:21][C:22](=[O:23])[O:24][CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[C:32](=[O:33])([O-:34])[O-:35].[CH3:38][C:39]#[N:40].[Cs+:36].[Cs+:37].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH2:10][OH:11])[cH:6][cH:7]1>>[O:1]([c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH2:10][OH:11])[cH:6][cH:7]1)[CH2:13][CH2:14][CH:15]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[NH:21][C:22](=[O:23])[O:24][CH2:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 19660Carbonate IonHCID 824523-(4-Hydroxyphenyl)propanolHCID 104967Cesium cation2×HCID 15857342HCID 15857342, compound

Product 1

HCID 22462878HCID 22462878, compound

Sources & evidence

ORD record
ord-67e7e2a6f39048eb8857fb8162d3be85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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