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Bicarbonate Ion → 2,2,2-Trifluoro-1-[3-(3-fluorophenyl)-4-[(1-naphthalen-1-ylethylamino)methyl]piperidin-1-yl]ethanone

HRID 99724
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HRID 99724 반응식
[C:35]([O:36][BH-:37]([O:38][C:39](=[O:40])[CH3:41])[O:42][C:43](=[O:44])[CH3:45])(=[O:46])[CH3:47].[C:49](=[O:50])([O-:51])[OH:52].[Cl:54][CH2:55][Cl:56].[F:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][N:10]([C:16]([C:17]([F:18])([F:19])[F:20])=[O:21])[CH2:11][CH2:12][CH:13]2[CH:14]=[O:15])[cH:5][cH:6][cH:7]1.[Na+:48].[Na+:53].[c:22]1([CH:32]([CH3:33])[NH2:34])[cH:23][cH:24][cH:25][c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]12>>[F:1][c:2]1[cH:3][c:4]([CH:8]2[CH2:9][N:10]([C:16]([C:17]([F:18])([F:19])[F:20])=[O:21])[CH2:11][CH2:12][CH:13]2[CH2:14][NH:34][CH:32]([c:22]2[cH:23][cH:24][cH:25][c:26]3[cH:27][cH:28][cH:29][cH:30][c:31]23)[CH3:33])[cH:5][cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 6344DichloromethaneHCID 980891-(1-Naphthyl)ethylamineHCID 2724942TriacetoxyborohydrideHCID 178519762HCID 178519762, 화합물

생성물 1

HCID 72536203
2,2,2-Trifluoro-1-[3-(3-fluorophenyl)-4-[(1-naphthalen-1-ylethylamino)methyl]piperidin-1-yl]ethanone

출처 및 근거

ORD 기록
ord-114ee8409c37487ba71e09ebbdd45326
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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