Diethyl Ether → HCID 22996251, compound
Reaction equation
[Br:1][c:2]1[c:3]([O:11][CH3:12])[cH:4][cH:5][c:6]([CH2:8][O:9][CH3:10])[cH:7]1.[C-:23]#[N:24].[C-:26]#[N:27].[CH3:13][N:14]([CH3:15])[CH:16]=[O:17].[CH3:18][CH2:19][O:20][CH2:21][CH3:22].[Zn+2:25].[cH:28]1[cH:29][cH:30][c:31]([P:32]([Pd:33]([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)([P:53]([c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)[c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[P:72]([c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)[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)[cH:103][cH:104]1>>[c:2]1([C:13]#[N:14])[c:3]([O:11][CH3:12])[cH:4][cH:5][c:6]([CH2:8][O:9][CH3:10])[cH:7]1Participants
7
Sources & evidence
- ORD record
- ord-72cf823fee0f4c059ca4e545528a158c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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