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Carbonate Ion → HCID 44518227, 화합물

HRID 1539185
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HRID 1539185 반응식
[C:35](=[O:36])([O-:37])[O-:38].[CH2:71]1[O:72][CH2:73][CH2:74][O:75][CH2:76]1.[CH:115](=[CH:116][C:117]([CH:118]=[CH:119][c:120]1[cH:121][cH:122][cH:123][cH:124][cH:125]1)=[O:126])[c:127]1[cH:128][cH:129][cH:130][cH:131][cH:132]1.[CH:1]1([P:2]([CH:3]2[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2-[c:15]2[c:16]([CH:17]([CH3:18])[CH3:19])[cH:20][c:21]([CH:22]([CH3:23])[CH3:24])[cH:25][c:26]2[CH:27]([CH3:28])[CH3:29])[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34]1.[CH:79](=[CH:80][C:81]([CH:82]=[CH:83][c:84]1[cH:85][cH:86][cH:87][cH:88][cH:89]1)=[O:90])[c:91]1[cH:92][cH:93][cH:94][cH:95][cH:96]1.[CH:97](=[CH:98][C:99]([CH:100]=[CH:101][c:102]1[cH:103][cH:104][cH:105][cH:106][cH:107]1)=[O:108])[c:109]1[cH:110][cH:111][cH:112][cH:113][cH:114]1.[Cl:41][c:42]1[cH:43][cH:44][c:45]2[c:46]([n:47]1)[n:48](-[c:51]1[cH:52][c:53]([C:54]#[N:55])[cH:56][cH:57][cH:58]1)[cH:49][n:50]2.[Cs+:39].[Cs+:40].[F:59][c:60]1[cH:61][c:62]([CH:66]2[NH:67][CH2:68][CH2:69][CH2:70]2)[cH:63][cH:64][cH:65]1.[Pd:77].[Pd:78]>>[c:42]1([N:67]2[CH:66]([c:62]3[cH:61][c:60]([F:59])[cH:65][cH:64][cH:63]3)[CH2:70][CH2:69][CH2:68]2)[cH:43][cH:44][c:45]2[c:46]([n:47]1)[n:48](-[c:51]1[cH:52][c:53]([C:54]#[N:55])[cH:56][cH:57][cH:58]1)[cH:49][n:50]2
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 19660Carbonate IonHCID 23938Palladium2회HCID 312751,4-DioxaneHCID 95417Dibenzylidene acetone3회HCID 104967Cesium cation2회HCID 39124022-(3-Fluorophenyl)pyrrolidineHCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenyl
HCID 58335594HCID 58335594, 화합물

생성물 1

HCID 44518227HCID 44518227, 화합물

출처 및 근거

ORD 기록
ord-3f0abcb609394127b3bf3c2d3b52c0b3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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