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Ammonium → 2-[[3-[(5-Methyl-2-phenyl-4-oxazolyl)methoxy]-5-isoxazolyl]methoxy]nicotinaldehyde

HRID 2141682
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HRID 2141682 반응식
[CH2:38]([Al+:39][CH2:40][CH:41]([CH3:42])[CH3:43])[CH:44]([CH3:45])[CH3:46].[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[n:16][o:17][c:18]([CH2:20][O:21][c:22]3[c:23]([C:24]#[N:25])[cH:26][cH:27][cH:28][n:29]3)[cH:19]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1.[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[CH3:55][CH2:56][CH2:57][CH2:58][CH2:59][CH3:60].[Cl-:47].[H-:37].[NH4+:48]>>[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[n:16][o:17][c:18]([CH2:20][O:21][c:22]3[c:23]([CH:24]=[O:51])[cH:26][cH:27][cH:28][n:29]3)[cH:19]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 223AmmoniumHCID 312ChlorideHCID 1140TolueneHCID 8058HexaneHCID 8857Ethyl AcetateHCID 166653HydrideHCID 16686348Bis(2-methylpropyl)alumanylium
HCID 68886145
2-[[3-[(5-Methyl-2-phenyl-4-oxazolyl)methoxy]-5-isoxazolyl]methoxy]nicotinonitrile

생성물 1

HCID 865915712-[[3-[(5-Methyl-2-phenyl-4-oxazolyl)methoxy]-5-isoxazolyl]methoxy]nicotinaldehyde

출처 및 근거

ORD 기록
ord-8e07273f265f4894846f030066dc3a41
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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