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Sodium Ion → 4-Methyl-8-(1-propan-2-ylpiperidin-4-yl)oxy-2-(4,4,4-trifluoro-3-hydroxybutyl)-3,4-dihydropyrazino[1,2-a]indol-1-one

HRID 310439
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인쇄 미리보기

반응식

HRID 310439 반응식
[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][CH:7]([O:10][c:11]2[cH:12][c:13]3[cH:14][c:15]4[n:16]([c:17]3[cH:18][cH:19]2)[CH:20]([CH3:25])[CH2:21][NH:22][C:23]4=[O:24])[CH2:8][CH2:9]1.[F:28][C:29]([CH:30]([CH2:31][CH2:32][OH:33])[OH:34])([F:35])[F:36].[F:37].[H-:26].[Na+:27]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][CH:7]([O:10][c:11]2[cH:12][c:13]3[cH:14][c:15]4[n:16]([c:17]3[cH:18][cH:19]2)[CH:20]([CH3:25])[CH2:21][N:22]([CH2:32][CH2:31][CH:30]([C:29]([F:28])([F:35])[F:36])[OH:34])[C:23]4=[O:24])[CH2:8][CH2:9]1
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참가 물질

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반응물 5

HCID 923Sodium IonHCID 14917Hydrofluoric AcidHCID 166653HydrideHCID 52317174,4,4-Trifluoro-1,3-butanediolHCID 684633554-methyl-8-(1-propan-2-ylpiperidin-4-yl)oxy-3,4-dihydro-2H-pyrazino[1,2-a]indol-1-one

생성물 1

HCID 684632954-Methyl-8-(1-propan-2-ylpiperidin-4-yl)oxy-2-(4,4,4-trifluoro-3-hydroxybutyl)-3,4-dihydropyrazino[1,2-a]indol-1-one

출처 및 근거

ORD 기록
ord-be22392da4364c1e961c53187eb2eaff
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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