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1,2-Dimethoxyethane → HCID 67267092, 화합물

HRID 1145744
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HRID 1145744 반응식
[CH3:15][c:16]1[c:17]([B:23]([OH:24])[OH:25])[cH:18][cH:19][c:20]([CH3:22])[cH:21]1.[CH3:28][O:29][CH2:30][CH2:31][O:32][CH3:33].[CH3:34][CH2:35][O:36][C:37](=[O:38])[CH3:39].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH3:7])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]1.[Cs+:27].[F-:26].[cH:40]1[cH:41][cH:42][c:43]([P:44]([Pd:45]([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[P:84]([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)([c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[cH:115][cH:116]1>>[c:2]1(-[c:17]2[c:16]([CH3:15])[cH:21][c:20]([CH3:22])[cH:19][cH:18]2)[c:3]([C:4](=[O:5])[O:6][CH3:7])[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 28179Fluoride IonHCID 104967Cesium cationHCID 603613Benzoic acid, 2-chloro-6-nitro-, methyl esterHCID 4198739(2,4-Dimethylphenyl)boronic acidHCID 178420554HCID 178420554, 화합물

생성물 1

HCID 67267092HCID 67267092, 화합물

출처 및 근거

ORD 기록
ord-937d011ee045408b82a2fe63b15f0640
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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