Acetone → HCID 68814796, compound

HRID 688923Notes

Reaction equation

HRID 688923 reaction equation
[Br:37][CH2:38][C:39]#[N:40].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9](-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[n:10]([CH3:24])[c:11]2[cH:12][cH:13][c:14](-[c:17]3[cH:18][cH:19][c:20]([OH:23])[cH:21][cH:22]3)[cH:15][c:16]12.[CH3:41][C:42](=[O:43])[CH3:44].[K+:31].[K+:32].[O-:33][C:34]([O-:35])=[O:36]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9](-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[n:10]([CH3:24])[c:11]2[cH:12][cH:13][c:14](-[c:17]3[cH:18][cH:19][c:20]([O:23][CH2:38][C:39]#[N:40])[cH:21][cH:22]3)[cH:15][c:16]12

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 68813921HCID 68813921, compound

Product 1

HCID 68814796HCID 68814796, compound

Sources & evidence

ORD record
ord-9ab2a41048864ee8bd712779e2879876
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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