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Hydrochloric Acid → 1-[4-[(8-cyclohexyl-2,8-diazaspiro[4.5]decan-2-yl)methyl]phenyl]-N-(1H-imidazol-2-ylmethyl)methanamine

HRID 88206
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반응식

HRID 88206 반응식
[BH4-:41].[CH3:44][OH:45].[CH:36]([O-:37])([O-:38])[O:39][CH3:40].[CH:4]1([N:10]2[CH2:11][CH2:12][C:13]3([CH2:14][CH2:15][N:16]([CH2:18][c:19]4[cH:20][cH:21][c:22]([CH2:25][NH2:26])[cH:23][cH:24]4)[CH2:17]3)[CH2:27][CH2:28]2)[CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]1.[ClH:1].[ClH:2].[ClH:3].[Na+:42].[OH2:43].[nH:29]1[c:30]([CH:34]=[O:35])[n:31][cH:32][cH:33]1>>[CH:4]1([N:10]2[CH2:11][CH2:12][C:13]3([CH2:14][CH2:15][N:16]([CH2:18][c:19]4[cH:20][cH:21][c:22]([CH2:25][NH:26][CH2:34][c:30]5[nH:29][cH:33][cH:32][n:31]5)[cH:23][cH:24]4)[CH2:17]3)[CH2:27][CH2:28]2)[CH2:5][CH2:6][CH2:7][CH2:8][CH2:9]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric Acid3회HCID 887MethanolHCID 923Sodium IonHCID 962WaterHCID 249551H-imidazole-2-carbaldehydeHCID 28123BorohydrideHCID 53629101Methylorthoformate
HCID 68951507
[4-[(8-Cyclohexyl-2,8-diazaspiro[4.5]decan-2-yl)methyl]phenyl]methanamine

생성물 1

HCID 689674651-[4-[(8-cyclohexyl-2,8-diazaspiro[4.5]decan-2-yl)methyl]phenyl]-N-(1H-imidazol-2-ylmethyl)methanamine

출처 및 근거

ORD 기록
ord-d9d7dc6bec1a40ff98998ac96c871007
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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