Isophorone → Beta-Isophorone

HRID 1214954Notes

Reaction equation

HRID 1214954 reaction equation
[CH3:1][C:2]1([CH3:10])[CH2:3][C:4](=[O:9])[CH:5]=[C:6]([CH3:8])[CH2:7]1.[OH:11][CH2:12][CH2:13][N:14]([CH2:15][CH2:16][OH:17])[CH2:18][CH2:19][OH:20]>>[CH3:1][C:2]1([CH3:10])[CH2:3][C:4](=[O:9])[CH2:5][C:6]([CH3:8])=[CH:7]1

Participants

3

Reactant 2

HCID 6544IsophoroneHCID 7618Triethanolamine

Product 1

HCID 10108Beta-Isophorone

Sources & evidence

ORD record
ord-b663112b751744f4861bd831ce088983
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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