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Methane → 1-(3-Cyclohexyl-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)-4-(4-methoxyphenyl)piperazine

HRID 685889
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HRID 685889 반응식
[C:2]1(=[C:8]2[C:9]([CH3:34])([CH3:35])[O:10][c:11]3[c:12]2[c:13]([CH3:33])[c:14]([N:19]2[CH2:20][CH2:21][N:22]([c:25]4[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[CH2:23][CH2:24]2)[c:15]([CH3:18])[c:16]3[CH3:17])[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1.[C:41].[CH3:36][CH2:37][OH:38].[CH3:39][OH:40].[ClH:1].[Pd:42]>>[CH:2]1([CH:8]2[C:9]([CH3:34])([CH3:35])[O:10][c:11]3[c:12]2[c:13]([CH3:33])[c:14]([N:19]2[CH2:20][CH2:21][N:22]([c:25]4[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]4)[CH2:23][CH2:24]2)[c:15]([CH3:18])[c:16]3[CH3:17])[CH2:3][CH2:4][CH2:5][CH2:6][CH2:7]1
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참가 물질

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반응물 6

HCID 297MethaneHCID 313Hydrochloric AcidHCID 702EthanolHCID 887MethanolHCID 23938PalladiumHCID 102265081-(3-Cyclohexylidene-2,2,4,6,7-pentamethyl-1-benzofuran-5-yl)-4-(4-methoxyphenyl)piperazine

생성물 1

HCID 10276500
1-(3-Cyclohexyl-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl)-4-(4-methoxyphenyl)piperazine

출처 및 근거

ORD 기록
ord-d8bb2d0f5291414c855b28cfc396a40b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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