Acetone → HCID 13565195, compound

HRID 142699Notes

Reaction equation

HRID 142699 reaction equation
[C:29](=[O:30])([O-:31])[O-:32].[CH2:1]([CH:2]([CH3:3])[CH3:4])[NH:5][CH:6]([C:7]#[N:8])[c:9]1[cH:10][c:11]([O:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:12][cH:13][cH:14]1.[CH3:22][O:23][S:24]([O:25][CH3:26])(=[O:27])=[O:28].[CH3:35][C:36](=[O:37])[CH3:38].[K+:33].[K+:34]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:5]([CH:6]([C:7]#[N:8])[c:9]1[cH:10][c:11]([O:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:12][cH:13][cH:14]1)[CH3:22]

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 6497Dimethyl SulfateHCID 19660Carbonate IonHCID 13565194HCID 13565194, compound

Product 1

HCID 13565195HCID 13565195, compound

Sources & evidence

ORD record
ord-6bbc3ba7c21b4642a21f0953bf9eb5c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…