tert-Butanol → CMLDBU00002581

HRID 1567129Notes

Reaction equation

HRID 1567129 reaction equation
[C:1]1(=[O:7])[CH:2]=[CH:3][CH2:4][CH2:5][CH2:6]1.[C:8]([CH2:9][C:10](=[O:11])[O:12][CH3:13])(=[O:14])[O:15][CH3:16].[CH3:17][C:18]([OH:19])([CH3:20])[CH3:21]>>[C:1]1(=[O:7])[CH2:2][CH:3]([CH:9]([C:8](=[O:14])[O:15][CH3:16])[C:10](=[O:11])[O:12][CH3:13])[CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 6386tert-ButanolHCID 7943Dimethyl malonateHCID 135942-Cyclohexen-1-one

Product 1

HCID 358296CMLDBU00002581

Sources & evidence

ORD record
ord-47e35d8a1b124febbe12c8ef45d972d3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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