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Methanol → 2-(4-Fluoro-3-isobutyramidophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylic acid

HRID 148261
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HRID 148261 반응식
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:12]([cH:13][cH:14]1)[NH:11][CH:10]([c:15]1[cH:16][c:17]([NH:22][C:23]([CH:24]([CH3:25])[CH3:26])=[O:27])[c:18]([F:21])[cH:19][cH:20]1)[C:9]([CH3:28])([CH3:29])[CH2:8]2.[CH3:33][OH:34].[Na+:31].[OH-:30].[OH2:32]>>[O:2]=[C:3]([OH:4])[c:5]1[cH:6][c:7]2[c:12]([cH:13][cH:14]1)[NH:11][CH:10]([c:15]1[cH:16][c:17]([NH:22][C:23]([CH:24]([CH3:25])[CH3:26])=[O:27])[c:18]([F:21])[cH:19][cH:20]1)[C:9]([CH3:28])([CH3:29])[CH2:8]2
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반응물 5

HCID 887MethanolHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 67441749Methyl-2-(4-fluoro-3-isobutyramidophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylate

생성물 1

HCID 674405182-(4-Fluoro-3-isobutyramidophenyl)-3,3-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxylic acid

출처 및 근거

ORD 기록
ord-f2d28baa48cd42e28c128e421bed428b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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