Ethanol → HCID 21108549, compound

HRID 672899Notes

Reaction equation

HRID 672899 reaction equation
[C-:38]#[N:39].[CH3:41][CH2:42][OH:43].[K+:40].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][CH2:9][S:10][CH2:11][c:12]1[n:13][n:14][c:15](-[c:17]2[cH:18][cH:19][c:20]([CH:21]=[O:22])[cH:23][cH:24]2)[o:16]1.[S:25](=[O:26])(=[O:27])([c:28]1[cH:29][cH:30][c:31]([CH3:32])[cH:33][cH:34]1)[CH2:35][N+:36]#[C-:37]>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][CH2:9][S:10][CH2:11][c:12]1[n:13][n:14][c:15](-[c:17]2[cH:18][cH:19][c:20]([CH:21]3[O:22][CH:37]=[N:36][CH:35]3[S:25](=[O:26])(=[O:27])[c:28]3[cH:29][cH:30][c:31]([CH3:32])[cH:33][cH:34]3)[cH:23][cH:24]2)[o:16]1

Participants

6

Reactant 5

HCID 702EthanolHCID 813Potassium CationHCID 5975CyanideHCID 161915Tosylmethyl isocyanideHCID 21108583HCID 21108583, compound

Product 1

HCID 21108549HCID 21108549, compound

Sources & evidence

ORD record
ord-5595c2f12f8b435199190b4d03adf05d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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