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Ammonium → O-methyl 2,2-bis(fluoromethyl)-6-trifluoromethyl-2H-1-benzopyran-4-carbothioate

HRID 123564
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HRID 123564 반응식
[Br:1][C:2]1=[CH:3][C:4]([CH2:16][F:17])([CH2:18][F:19])[O:5][c:6]2[c:7]1[cH:8][c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]2.[CH2:20]([Li:21])[CH2:22][CH2:23][CH3:24].[CH3:25][O:26][C:27]([O:28][CH3:29])=[S:30].[CH3:33][O:34][C:35]([CH3:36])([CH3:37])[CH3:38].[Cl-:31].[NH4+:32]>>[C:2]1([C:27]([O:26][CH3:25])=[S:30])=[CH:3][C:4]([CH2:16][F:17])([CH2:18][F:19])[O:5][c:6]2[c:7]1[cH:8][c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]2
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7

반응물 6

HCID 223AmmoniumHCID 312ChlorideHCID 15413tert-Butyl methyl etherHCID 136867O,O'-Dimethyl monothiocarbonateHCID 184244094-bromo-2,2-bis(fluoromethyl)-6-trifluoromethyl-2H-1-benzopyranHCID 178418339Butyllithium

생성물 1

HCID 18424412O-methyl 2,2-bis(fluoromethyl)-6-trifluoromethyl-2H-1-benzopyran-4-carbothioate

출처 및 근거

ORD 기록
ord-ca143603f4944d2190fec68c431945c7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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