Diisopropylethylamine → HCID 178515639, 화합물

반응식

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][Br:22])[O:23][CH:24]2[O:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12.[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[NH:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46][CH2:47][CH2:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[CH:55]([N:56]([CH:57]([CH3:58])[CH3:59])[CH2:60][CH3:61])([CH3:62])[CH3:63]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:20]([CH2:21][N:37]([CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46][CH2:47][CH2:48][c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[O:23][CH:24]2[O:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[c:13]2[cH:14][cH:15][c:16](=[O:19])[nH:17][c:18]12

참가 물질

반응물 3

HCID 81531Diisopropylethylamine

HCID 10914757N-benzyl-6-(4-phenylbutoxy)hexan-1-amine

HCID 178515506HCID 178515506, 화합물

생성물 1

HCID 178515639HCID 178515639, 화합물

출처 및 근거

ORD 기록: ord-9e621f460f6b4d6385987d7e1becc60b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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