Acetone → HCID 53916869, compound

HRID 1212510Notes

Reaction equation

HRID 1212510 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:21])[c:6]([CH2:18][CH2:19][CH3:20])[c:7]([O:8][CH2:9][CH2:10][CH2:11][S:12][CH2:13][CH2:14][Br:15])[cH:16][cH:17]1.[CH3:26][C:27](=[O:28])[CH3:29].[K+:22].[S-:23][C:24]#[N:25]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:21])[c:6]([CH2:18][CH2:19][CH3:20])[c:7]([O:8][CH2:9][CH2:10][CH2:11][S:12][CH2:13][CH2:14][S:23][C:24]#[N:25])[cH:16][cH:17]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 813Potassium CationHCID 9322ThiocyanateHCID 13885752HCID 13885752, compound

Product 1

HCID 53916869HCID 53916869, compound

Sources & evidence

ORD record
ord-89553390be1747e2a0dc7de5cd35a75d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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