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1,2-Dichloroethane → 1-(2-{Ethyl-[2-(4-methoxyphenyl)-1-methylethyl]amino}ethyl)-azepan-2-one

HRID 1229524
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인쇄 미리보기

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HRID 1229524 반응식
[C:26]([O:27][BH-:28]([O:29][C:30](=[O:31])[CH3:32])[O:33][C:34](=[O:35])[CH3:36])(=[O:37])[CH3:38].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][CH:10]([CH3:11])[NH:12][CH2:13][CH3:14])[cH:7][cH:8]1.[Cl:40][CH2:41][CH2:42][Cl:43].[Na+:39].[O:15]=[C:16]1[N:17]([CH2:23][CH:24]=[O:25])[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:9][CH:10]([CH3:11])[N:12]([CH2:13][CH3:14])[CH2:24][CH2:23][N:17]2[C:16](=[O:15])[CH2:22][CH2:21][CH2:20][CH2:19][CH2:18]2)[cH:7][cH:8]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 111,2-DichloroethaneHCID 923Sodium IonHCID 857254-methoxy-N-ethylamphetamineHCID 2724942TriacetoxyborohydrideHCID 62024269(2-Oxo-azepan-1-yl)acetaldehyde

생성물 1

HCID 121126971-(2-{Ethyl-[2-(4-methoxyphenyl)-1-methylethyl]amino}ethyl)-azepan-2-one

출처 및 근거

ORD 기록
ord-dce43befc5064c089dd50e6a57a3de8f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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