Ethanol → HCID 22175279, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12]([O:28][S:29]([C:30]([F:31])([F:32])[F:33])(=[O:34])=[O:35])[c:13]([C:24](=[O:25])[O:26][CH3:27])[n:14]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:15](=[O:19])[c:16]2[cH:17][cH:18]1.[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH3:59][CH2:60][OH:61].[F:36][c:37]1[c:38]([B:43]([OH:44])[OH:45])[cH:39][cH:40][cH:41][cH:42]1.[Na+:46].[Na+:47].[O-:48][C:49](=[O:50])[O-:51].[OH2:62].[cH:63]1[cH:64][cH:65][c:66]([P:67]([Pd:68]([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)([P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[P:107]([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)([c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)([c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[cH:138][cH:139]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]2[c:12](-[c:38]3[c:37]([F:36])[cH:42][cH:41][cH:40][cH:39]3)[c:13]([C:24](=[O:25])[O:26][CH3:27])[n:14]([CH2:20][CH:21]([CH3:22])[CH3:23])[c:15](=[O:19])[c:16]2[cH:17][cH:18]1Participants
9
Sources & evidence
- ORD record
- ord-5e336ff9f85e481f9eb273bca3877d53
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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