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Sodium Ion → (4-Cyclopentyl-benzyl)-[2-(3,4-dichloro-phenyl)-ethyl]-amine

HRID 2347602
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HRID 2347602 반응식
[BH4-:49].[CH:1]1([c:2]2[cH:3][cH:4][c:5]([CH2:6][NH:7][CH2:8][CH2:9][c:10]3[cH:11][cH:12][c:13]([F:14])[c:15]([C:16]([F:17])([F:18])[F:19])[cH:20]3)[cH:21][cH:22]2)[CH2:23][CH2:24]1.[CH:25]1([c:30]2[cH:31][cH:32][c:33]([CH:34]=[O:35])[cH:36][cH:37]2)[CH2:26][CH2:27][CH2:28][CH2:29]1.[Cl:38][c:39]1[cH:40][c:41]([CH2:46][CH2:47][NH2:48])[cH:42][cH:43][c:44]1[Cl:45].[Na+:50]>>[CH:25]1([c:30]2[cH:31][cH:32][c:33]([CH2:34][NH:48][CH2:47][CH2:46][c:41]3[cH:40][c:39]([Cl:38])[c:44]([Cl:45])[cH:43][cH:42]3)[cH:36][cH:37]2)[CH2:26][CH2:27][CH2:28][CH2:29]1
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반응물 5

HCID 923Sodium IonHCID 28123BorohydrideHCID 2179583,4-DichlorophenethylamineHCID 3016187p-CyclopentylbenzaldehydeHCID 69342889(4-Cyclopropylbenzyl)-[2-(4-fluoro-3-trifluoromethylphenyl)-ethyl]-amine

생성물 1

HCID 69342726(4-Cyclopentyl-benzyl)-[2-(3,4-dichloro-phenyl)-ethyl]-amine

출처 및 근거

ORD 기록
ord-dc5453e9a7664c00a0abd37f4135b0d4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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