Hydrochloric Acid → 4-(9,10-dihydro-10-methyl-4H-benzo[4,5]-cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidine

반응식

[CH3:1][CH:2]1[CH2:3][c:4]2[c:5]([cH:20][cH:21][cH:22][cH:23]2)[C:6]([OH:12])([CH:13]2[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]2)[c:7]2[c:8]1[s:9][cH:10][cH:11]2.[CH:25]([OH:26])([CH3:27])[CH3:28].[ClH:24]>>[CH3:1][CH:2]1[CH2:3][c:4]2[c:5]([cH:20][cH:21][cH:22][cH:23]2)[C:6](=[C:13]2[CH2:14][CH2:15][N:16]([CH3:19])[CH2:17][CH2:18]2)[c:7]2[c:8]1[s:9][cH:10][cH:11]2

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 3776Isopropanol

HCID 233418319,10-dihydro-10-methyl-4-(1-methyl-4-piperidyl)-4H-benzo[4,5]cyclohepta-[1,2-b]thiophen-4-ol

생성물 1

HCID 1915134-(9,10-dihydro-10-methyl-4H-benzo[4,5]-cyclohepta[1,2-b]thiophen-4-ylidene)-1-methylpiperidine

출처 및 근거

ORD 기록: ord-940855dbf2b94cb3b7c87ffe09a68ccb
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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