Acetone → HCID 178436828, compound

HRID 158925Notes

Reaction equation

HRID 158925 reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([CH3:15])[n:5][c:6]2[n:7]([c:8]1=[O:9])[c:10]([CH3:14])[cH:11][cH:12][cH:13]2.[CH3:26][C:27](=[O:28])[CH3:29].[OH:16][C:17](=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][c:24]1[OH:25]>>[CH2:1]([CH3:2])[c:3]1[c:4]([CH3:15])[nH+:5][c:6]2[n:7]([c:8]1=[O:9])[c:10]([CH3:14])[cH:11][cH:12][cH:13]2.[O:16]=[C:17]([O-:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][c:24]1[OH:25]

Participants

5

Reactant 3

HCID 180AcetoneHCID 338Salicylic AcidHCID 93406CH 150

Product 2

HCID 178436828HCID 178436828, compoundHCID 178524311Salicylate

Sources & evidence

ORD record
ord-528fa0e194d34639883ca23cecaa7e5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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