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Potassium Cation → 1-(2-Methylsulfanylethyl)-4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine

HRID 123992
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HRID 123992 반응식
[C:28](=[O:29])([O-:30])[O-:31].[CH3:1][C:2]1([CH3:22])[CH2:3][CH:4]([c:10]2[c:11]([N:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[cH:12][cH:13][cH:14][cH:15]2)[CH2:5][C:6]([CH3:8])([CH3:9])[CH2:7]1.[CH3:23][S:24][CH2:25][CH2:26][Cl:27].[CH3:34][C:35]#[N:36].[K+:32].[K+:33]>>[CH3:1][C:2]1([CH3:22])[CH2:3][CH:4]([c:10]2[c:11]([N:16]3[CH2:17][CH2:18][N:19]([CH2:26][CH2:25][S:24][CH3:23])[CH2:20][CH2:21]3)[cH:12][cH:13][cH:14][cH:15]2)[CH2:5][C:6]([CH3:8])([CH3:9])[CH2:7]1
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반응물 5

HCID 813Potassium Cation2회HCID 6342AcetonitrileHCID 109652-Chloroethyl methyl sulfideHCID 19660Carbonate IonHCID 119922841-[2-(3,3,5,5-Tetramethylcyclohexyl)phenyl]piperazine

생성물 1

HCID 231427851-(2-Methylsulfanylethyl)-4-[2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine

출처 및 근거

ORD 기록
ord-4dc0c085fd7347908b5372edbf9ca6c6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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