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Ammonium → 2-((1R,4r)-4-(4-chlorophenyl)cyclohexyl)naphthalene-1,4-dione

HRID 680418
Notes
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Reaction equation

HRID 680418 reaction equation
[Ag+:49].[CH3:17][C:18]#[N:19].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][CH2:10][CH:11]([C:14]([OH:15])=[O:16])[CH2:12][CH2:13]2)[cH:6][cH:7]1.[N+:45]([O-:46])([O-:47])=[O:48].[NH4+:42].[NH4+:43].[O:20]=[C:21]1[CH:22]=[CH:23][C:24](=[O:25])[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]21.[OH2:44].[S:32]([O:33][O:34][S:35]([O-:36])(=[O:37])=[O:38])([O-:39])(=[O:40])=[O:41]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]2[CH2:9][CH2:10][CH:11]([C:14]3=[CH:22][C:21](=[O:20])[c:31]4[c:26]([cH:27][cH:28][cH:29][cH:30]4)[C:24]3=[O:25])[CH2:12][CH2:13]2)[cH:6][cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 223Ammonium2×HCID 943NitrateHCID 962WaterHCID 6342AcetonitrileHCID 85301,4-NaphthoquinoneHCID 104755Silver cationHCID 107879Peroxydisulfate
HCID 2735792
4-(4-Chlorophenyl)cyclohexane-1-carboxylic acid

Product 1

HCID 251644132-((1R,4r)-4-(4-chlorophenyl)cyclohexyl)naphthalene-1,4-dione

Sources & evidence

ORD record
ord-633a568b086943f9957bbb3cc265594a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes