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Ammonium → 4-[2-Hydroxy-3-[[1-(3,3,3-trifluoropropyl)piperidin-4-yl]methylamino]propoxy]phenol

HRID 668064
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HRID 668064 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]([CH2:16][NH:17][CH2:18][CH:19]2[CH2:20][CH2:21][N:22]([CH2:25][CH2:26][C:27]([F:28])([F:29])[F:30])[CH2:23][CH2:24]2)[OH:31])[cH:32][cH:33]1.[CH3:38][OH:39].[CH:34]([O-:35])=[O:36].[NH4+:37]>>[OH:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]([CH2:16][NH:17][CH2:18][CH:19]2[CH2:20][CH2:21][N:22]([CH2:25][CH2:26][C:27]([F:28])([F:29])[F:30])[CH2:23][CH2:24]2)[OH:31])[cH:32][cH:33]1
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반응물 4

HCID 223AmmoniumHCID 283FormateHCID 887MethanolHCID 235534821-(4-Phenylmethoxyphenoxy)-3-[[1-(3,3,3-trifluoropropyl)piperidin-4-yl]methylamino]propan-2-ol

생성물 1

HCID 235535084-[2-Hydroxy-3-[[1-(3,3,3-trifluoropropyl)piperidin-4-yl]methylamino]propoxy]phenol

출처 및 근거

ORD 기록
ord-592fca19bf204e34af5f7243089975f4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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