Ethanol → HCID 69553875, 화합물

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[CH3:42][NH2:43].[CH3:44][CH2:45][OH:46].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]=[CH:10][c:11]2[o:12][cH:13][c:14]([CH2:16][O:17][c:18]3[cH:19][cH:20][c:21]([CH2:24][CH2:25][CH2:26][CH2:27][n:28]4[c:29]([CH2:33][CH2:34][C:35](=[O:36])[O:37][CH2:38][CH3:39])[n:30][cH:31][cH:32]4)[cH:22][cH:23]3)[n:15]2)[cH:7][cH:8]1)([F:40])[F:41]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6]([CH:9]=[CH:10][c:11]2[o:12][cH:13][c:14]([CH2:16][O:17][c:18]3[cH:19][cH:20][c:21]([CH2:24][CH2:25][CH2:26][CH2:27][n:28]4[c:29]([CH2:33][CH2:34][C:35](=[O:36])[NH:43][CH3:42])[n:30][cH:31][cH:32]4)[cH:22][cH:23]3)[n:15]2)[cH:7][cH:8]1)([F:40])[F:41]

참가 물질

반응물 3

HCID 702Ethanol

HCID 6329Methylamine

HCID 69553493HCID 69553493, 화합물

생성물 1

HCID 69553875HCID 69553875, 화합물

출처 및 근거

ORD 기록: ord-2b3f531c953242ed95f6ea94b61d078a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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