Acetic Acid → HCID 21458554, compound

HRID 169080Notes

Reaction equation

HRID 169080 reaction equation
[C:14]([CH3:15])([CH3:16])([CH3:17])[OH:18].[CH3:1][O:2][C:3](=[O:4])[NH:5][c:6]1[n:7][c:8]([CH2:11][CH:12]=[O:13])[n:9][s:10]1.[CH3:20][C:21](=[O:22])[OH:23].[OH2:19]>>[CH3:1][O:2][C:3](=[O:4])[NH:5][c:6]1[n:7][c:8]([CH2:11][C:12](=[O:13])[OH:18])[n:9][s:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 6386tert-ButanolHCID 21458519HCID 21458519, compound

Product 1

HCID 21458554HCID 21458554, compound

Sources & evidence

ORD record
ord-2f1a8fc9ad0c42c69a935898aadb15d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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