1-Butanol → HCID 22176009, compound

HRID 2316981Notes

Reaction equation

HRID 2316981 reaction equation
[CH2:24]([CH2:25][CH2:26][CH3:27])[OH:28].[CH2:29]([P:30]([CH2:31][CH2:32][CH2:33][CH3:34])[CH2:35][CH2:36][CH2:37][CH3:38])[CH2:39][CH2:40][CH3:41].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([OH:23])[c:7]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[n:8]([CH2:13][C:14]([CH3:15])([CH3:16])[CH3:17])[c:9](=[O:12])[c:10]2[cH:11]1.[N:42]([C:43]([N:44]1[CH2:45][CH2:46][CH2:47][CH2:48][CH2:49]1)=[O:50])=[N:51][C:52]([N:53]1[CH2:54][CH2:55][CH2:56][CH2:57][CH2:58]1)=[O:59].[O:60]1[CH2:61][CH2:62][CH2:63][CH2:64]1>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([O:23][CH2:24][CH2:25][CH2:26][CH3:27])[c:7]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[n:8]([CH2:13][C:14]([CH3:15])([CH3:16])[CH3:17])[c:9](=[O:12])[c:10]2[cH:11]1

Participants

6

Sources & evidence

ORD record
ord-4bbd2271ae26472b8f33d6a30dfc2916
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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