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Ammonium → 3-methyl-1-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclobutylacetonitrile

HRID 1216810
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HRID 1216810 반응식
[B-:34]([F:35])([F:36])([F:37])[F:38].[CH3:1][CH:2]1[CH2:3][C:4]([n:6]2[n:7][cH:8][c:9](-[c:11]3[c:12]4[c:13]([n:14][cH:15][n:16]3)[n:17]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[cH:18][cH:19]4)[cH:10]2)([CH2:28][C:29]#[N:30])[CH2:5]1.[CH3:31][C:32]#[N:33].[Li+:39].[NH4+:40].[OH-:41].[OH2:42]>>[CH3:1][CH:2]1[CH2:3][C:4]([n:6]2[n:7][cH:8][c:9](-[c:11]3[c:12]4[c:13]([n:14][cH:15][n:16]3)[nH:17][cH:18][cH:19]4)[cH:10]2)([CH2:28][C:29]#[N:30])[CH2:5]1
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HCID 223AmmoniumHCID 961HydroxideHCID 962WaterHCID 6342AcetonitrileHCID 26255TetrafluoroborateHCID 28486Lithium ionHCID 670172343-methyl-1-[4-(7-[2-(trimethylsilyl)ethoxy]methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclobutylacetonitrile

생성물 1

출처 및 근거

ORD 기록
ord-fea6827f032649a4873efbdb93960c6b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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HCID 44232227
3-methyl-1-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]cyclobutylacetonitrile