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Bicarbonate Ion → 1-[(2-Methylquinolin-5-yl)amino]-4,4-dimethyl-2-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-ol

HRID 1227914
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HRID 1227914 반응식
[Cl:35][CH2:36][Cl:37].[F:1][C:2]([C:3]([CH2:4][C:5]([CH3:6])([CH3:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)([OH:14])[CH:15]=[N:16][c:17]1[c:18]2[cH:19][cH:20][c:21]([CH3:27])[n:22][c:23]2[cH:24][cH:25][cH:26]1)([F:28])[F:29].[Na+:34].[O-:30][C:31]([OH:32])=[O:33]>>[F:1][C:2]([C:3]1([OH:14])[CH2:4][C:5]([CH3:6])([CH3:7])[c:8]2[c:9]([cH:10][cH:11][cH:12][cH:13]2)[CH:15]1[NH:16][c:17]1[c:18]2[cH:19][cH:20][c:21]([CH3:27])[n:22][c:23]2[cH:24][cH:25][cH:26]1)([F:28])[F:29]
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5

반응물 4

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6344DichloromethaneHCID 179891651,1,1-Trifluoro-4-phenyl-2-[(2-methylquinolin-5-yl)iminomethyl]-4-methylpentan-2-ol

생성물 1

HCID 686823591-[(2-Methylquinolin-5-yl)amino]-4,4-dimethyl-2-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-ol

출처 및 근거

ORD 기록
ord-902829f7d3a0429fb4d58f89d572f476
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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