Acetone → HCID 178439760, compound

HRID 162044Notes

Reaction equation

HRID 162044 reaction equation
[CH3:21][CH2:22][OH:23].[CH3:24][C:25]([CH3:26])=[O:27].[NH3:1].[OH2:28].[n:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10]3[c:11]([n:12]2)[cH:13][c:14]2[c:15]([cH:16]3)[NH:17][C:18](=[O:20])[CH2:19]2)[cH:6][cH:7]1>>[n:2]1[cH:3][cH:4][c:5](-[c:8]2[nH:9][c:10]3[c:11]([n:12]2)[cH:13][c:14]2[c:15]([cH:16]3)[NH:17][C:18](=[O:20])[C:19]2=[C:25]([CH3:24])[CH3:26])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 222AmmoniaHCID 702EthanolHCID 962WaterHCID 178515303HCID 178515303, compound

Product 1

HCID 178439760HCID 178439760, compound

Sources & evidence

ORD record
ord-5ff5c3df1dd74efdb595892859ce2cb6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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