Water → 5-(3,7-Dimethylocta-2,6-dienyl)-7,8-dimethylspiro[chroman-2,1'-cyclobutan]-6-ol

Reaction equation

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

Participants

Reactant 4

HCID 962Water

HCID 44583,7-Dimethyl-2,6-octadienol

HCID 312751,4-Dioxane

HCID 578034927,8-Dimethyl-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-6-ol

Product 1

HCID 690568075-(3,7-Dimethylocta-2,6-dienyl)-7,8-dimethylspiro[chroman-2,1'-cyclobutan]-6-ol

Sources & evidence

ORD record: ord-5eb20e97e65346b38b559a63d9fff6cc
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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