Methanol → HCID 21962480, compound
Reaction equation
[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:60][OH:61].[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:39][CH2:40][NH:41][S:42](=[O:43])(=[O:44])[CH2:45][c:46]2[c:47]([F:52])[cH:48][cH:49][cH:50][cH:51]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[O:35][CH3:36])[cH:37][cH:38]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12.[Na+:59].[OH-:58]>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:39][CH2:40][NH:41][S:42](=[O:43])(=[O:44])[CH2:45][c:46]2[c:47]([F:52])[cH:48][cH:49][cH:50][cH:51]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([C:33](=[O:34])[OH:35])[cH:37][cH:38]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12Participants
6
Sources & evidence
- ORD record
- ord-cbf2b140e3a94764bd5954fc0bff7f00
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…