Ethanol → HCID 57827608, compound
Reaction equation
[CH3:1][CH2:2][OH:3].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[F:23][c:24]1[c:25]([B:30]([OH:31])[OH:32])[cH:26][cH:27][cH:28][cH:29]1.[F:4][C:5]([F:6])([F:7])[S:8]([O:9][C:10]1=[C:11]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[CH2:12][CH2:13][CH2:14][CH2:15]1)(=[O:21])=[O:22].[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([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)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([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)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([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)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[C:10]1([c:25]2[c:24]([F:23])[cH:29][cH:28][cH:27][cH:26]2)=[C:11]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[CH2:12][CH2:13][CH2:14][CH2:15]1Participants
8
Sources & evidence
- ORD record
- ord-8eea75a152e8440db736a868b43d044f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…