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Dichloromethane → HCID 69410554, 화합물

HRID 1224067
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HRID 1224067 반응식
[CH:31]([CH3:32])([CH3:33])[N:34]1[CH:35]([CH2:43][C:44](=[O:45])[OH:46])[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[CH2:42]1.[CH:71]([N:72]([CH2:73][CH3:74])[CH:75]([CH3:76])[CH3:77])([CH3:78])[CH3:79].[Cl:80][CH2:81][Cl:82].[NH2:1][CH:2]([C:3](=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[c:12]([CH2:17][n:18]3[n:19][cH:20][n:21][cH:22]3)[cH:13][cH:14][cH:15][cH:16]2)[CH2:9][CH2:10]1)[CH2:23][c:24]1[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]1.[P-:47]([F:48])([F:49])([F:50])([F:51])([F:52])[F:53].[n:54]1([O:55][C:56]([N:57]([CH3:58])[CH3:59])=[N+:60]([CH3:61])[CH3:62])[c:63]2[n:64][cH:65][cH:66][cH:67][c:68]2[n:69][n:70]1>>[NH:1]([CH:2]([C:3](=[O:4])[N:5]1[CH2:6][CH2:7][N:8]([c:11]2[c:12]([CH2:17][n:18]3[n:19][cH:20][n:21][cH:22]3)[cH:13][cH:14][cH:15][cH:16]2)[CH2:9][CH2:10]1)[CH2:23][c:24]1[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]1)[C:44]([CH2:43][CH:35]1[N:34]([CH:31]([CH3:32])[CH3:33])[CH2:42][c:41]2[c:36]1[cH:37][cH:38][cH:39][cH:40]2)=[O:45]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 17952314HCID 17952314, 화합물HCID 69409244HCID 69409244, 화합물

생성물 1

HCID 69410554
HCID 69410554, 화합물

출처 및 근거

ORD 기록
ord-f67ee5f288f94ba98a6af72f62b71673
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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