Acetonitrile → HCID 59496742, compound

HRID 1141716Notes

Reaction equation

HRID 1141716 reaction equation
[C:20](#[N:21])[c:22]1[cH:23][c:24]([CH2:25][Br:26])[cH:27][cH:28][cH:29]1.[C:33](=[O:34])([O-:35])[O-:36].[CH3:30][C:31]#[N:32].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[Cs+:37].[Cs+:38].[OH:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH:9]([NH:12][C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH2:8][CH2:7][CH2:6]2>>[O:1]([c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH:9]([NH:12][C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH2:8][CH2:7][CH2:6]2)[CH2:25][c:24]1[cH:23][c:22]([C:20]#[N:21])[cH:29][cH:28][cH:27]1

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 97249Benzonitrile, 3-(bromomethyl)-HCID 104967Cesium cation2×HCID 17776704HCID 17776704, compound

Product 1

HCID 59496742HCID 59496742, compound

Sources & evidence

ORD record
ord-72f25c7b5b8d452190b000337c05a0fd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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