Acetonitrile → HCID 86232905, compound

HRID 700841Notes

Reaction equation

HRID 700841 reaction equation
[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[n:11]2[cH:12][c:13]([CH2:22][OH:23])[cH:14][c:15]2-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1.[CH3:24][N+:25]1([O-:31])[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1.[CH3:32][C:33]#[N:34]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[n:11]2[cH:12][c:13]([CH:22]=[O:23])[cH:14][c:15]2-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:6][cH:7]1

Participants

4

Sources & evidence

ORD record
ord-164574ddea244bbd8e3f222f439efde2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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