Water → 4-(6-Isopropenyl-3-methylcyclohex-2-enyl)-5-methylbenzene-1,3-diol

Reaction equation

[C:23]([OH:24])(=[O:25])[C:26]([OH:27])=[O:28].[CH3:12][c:13]1[cH:14][c:15]([OH:20])[cH:16][c:17]([OH:18])[cH:19]1.[CH3:1][C:2]1([OH:11])[CH:3]=[CH:4][CH:5]([C:8](=[CH2:9])[CH3:10])[CH2:6][CH2:7]1.[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH3:36][CH2:37][O:38][CH2:39][CH3:40].[OH2:21].[OH2:22]>>[CH3:1][C:2]1=[CH:3][CH:4]([c:14]2[c:13]([CH3:12])[cH:19][c:17]([OH:18])[cH:16][c:15]2[OH:20])[CH:5]([C:8](=[CH2:9])[CH3:10])[CH2:6][CH2:7]1

Participants

Reactant 6

HCID 962Water2×

HCID 971Oxalic Acid

HCID 1140Toluene

HCID 3283Diethyl Ether

HCID 10436Orcinol

HCID 155626trans-1-Methyl-4-(1-methylvinyl)cyclohex-2-en-1-ol

Product 1

HCID 115797634-(6-Isopropenyl-3-methylcyclohex-2-enyl)-5-methylbenzene-1,3-diol

Sources & evidence

ORD record: ord-f206273486164bdfa609113f9cb336c1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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