Isoamyl Nitrite → HCID 66662501, 화합물

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[CH2:40]1[O:41][CH2:42][CH2:43][O:44][CH2:45]1.[CH3:1][CH:2]([CH2:3][CH2:4][O:5][N:6]=[O:7])[CH3:8].[NH2:9][c:10]1[s:11][cH:12][c:13](-[c:15]2[cH:16][cH:17][c:18]([C:21]3([C:24](=[O:25])[N:26]4[CH2:27][C:28]5([O:29][C:30](=[O:37])[c:31]6[c:32]5[cH:33][cH:34][cH:35][cH:36]6)[CH2:38][CH2:39]4)[CH2:22][CH2:23]3)[cH:19][cH:20]2)[n:14]1>>[cH:10]1[s:11][cH:12][c:13](-[c:15]2[cH:16][cH:17][c:18]([C:21]3([C:24](=[O:25])[N:26]4[CH2:27][C:28]5([O:29][C:30](=[O:37])[c:31]6[c:32]5[cH:33][cH:34][cH:35][cH:36]6)[CH2:38][CH2:39]4)[CH2:22][CH2:23]3)[cH:19][cH:20]2)[n:14]1

참가 물질

반응물 3

HCID 8053Isoamyl Nitrite

HCID 312751,4-Dioxane

HCID 870949171'-[1-[4-(2-Amino-1,3-thiazol-4-yl)phenyl]cyclopropanecarbonyl]spiro[2-benzofuran-3,3'-pyrrolidine]-1-one

생성물 1

HCID 66662501HCID 66662501, 화합물

출처 및 근거

ORD 기록: ord-c109846a78dd4169a637c7d676c739a8
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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