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Hexafluorophosphate → 6-(2,3,4,4a,9,9a-hexahydroindeno[2,1-b]pyridine-1-carbonyl)-3-methyl-1H-benzimidazol-2-one

HRID 91933
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인쇄 미리보기

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HRID 91933 반응식
[CH3:1][n:2]1[c:3](=[O:14])[nH:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([C:11](=[O:12])[OH:13])[cH:10]2.[NH:15]1[CH:16]2[CH:17]([CH2:18][CH2:19][CH2:20]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][c:26]1[CH2:27]2.[P-:28]([F:29])([F:30])([F:31])([F:32])([F:33])[F:34].[n:35]1([O:36][C:37]([N:38]([CH3:39])[CH3:40])=[N+:41]([CH3:42])[CH3:43])[c:44]2[n:45][cH:46][cH:47][cH:48][c:49]2[n:50][n:51]1.[nH:52]1[c:53]2[cH:54][cH:55][c:56]([C:57]([N:58]3[CH:59]4[CH:60]([c:61]5[cH:62][cH:63][cH:64][cH:65][c:66]5[CH2:67][CH2:68]4)[CH2:69][CH2:70][CH2:71]3)=[O:72])[cH:73][c:74]2[n:75][cH:76]1>>[CH3:1][n:2]1[c:3](=[O:14])[nH:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([C:11](=[O:13])[N:15]1[CH:16]3[CH:17]([CH2:18][CH2:19][CH2:20]1)[c:21]1[cH:22][cH:23][cH:24][cH:25][c:26]1[CH2:27]3)[cH:10]2
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참가 물질

6

반응물 5

HCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 125014332,3,4,4a,9,9a-hexahydro-1H-indeno[2,1-b]pyridineHCID 144248571-Methyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-carboxylic acidHCID 1785193462,3,4a,5,6,10b-hexahydro-1H-benzo[f]quinolin-4-yl(3H-benzimidazol-5-yl)methanone

생성물 1

HCID 67223380
6-(2,3,4,4a,9,9a-hexahydroindeno[2,1-b]pyridine-1-carbonyl)-3-methyl-1H-benzimidazol-2-one

출처 및 근거

ORD 기록
ord-63cc19104a4847759211afda1cebceef
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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