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Chloride → 1-[5-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-one

HRID 2350643
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HRID 2350643 반응식
[Al+3:10].[CH2:1]([CH3:2])[CH:3]([C:4](=[O:5])[Cl:6])[CH2:7][CH3:8].[CH3:13][c:14]1[c:15](-[c:21]2[cH:22][c:23]3[c:24]([cH:25][n:26]2)[nH:27][cH:28][cH:29]3)[c:16]([CH3:20])[cH:17][cH:18][cH:19]1.[Cl-:11].[Cl-:12].[Cl-:30].[Cl-:9].[Cl:32][CH2:33][Cl:34].[Na+:31]>>[CH2:1]([CH3:2])[CH:3]([C:4](=[O:5])[c:29]1[c:23]2[cH:22][c:21](-[c:15]3[c:14]([CH3:13])[cH:19][cH:18][cH:17][c:16]3[CH3:20])[n:26][cH:25][c:24]2[nH:27][cH:28]1)[CH2:7][CH3:8]
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반응물 6

HCID 312Chloride4회HCID 923Sodium IonHCID 6344DichloromethaneHCID 759542-Ethylbutyryl chlorideHCID 104727Aluminum CationHCID 671524405-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridine

생성물 1

HCID 671525261-[5-(2,6-dimethyl-phenyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-ethyl-butan-1-one

출처 및 근거

ORD 기록
ord-05153b7b880f40d8a1da058c70fba670
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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