Ammonium → HCID 17981682, compound

HRID 674163Notes

Reaction equation

HRID 674163 reaction equation
[CH3:42][CH2:43][OH:44].[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[n:7]1[c:8]([NH2:37])[n:9][c:10]2[c:11]1[cH:12][c:13](-[c:16]1[n:17][c:18](-[c:27]3[c:28]([F:36])[cH:29][c:30]([N+:33]([O-:34])=[O:35])[cH:31][cH:32]3)[nH:19][c:20]1-[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[cH:14][cH:15]2.[CH:38]([O-:39])=[O:40].[NH4+:41]>>[CH:1]([CH3:2])([CH3:3])[S:4](=[O:5])(=[O:6])[n:7]1[c:8]([NH2:37])[n:9][c:10]2[c:11]1[cH:12][c:13](-[c:16]1[n:17][c:18](-[c:27]3[c:28]([F:36])[cH:29][c:30]([NH2:33])[cH:31][cH:32]3)[nH:19][c:20]1-[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[cH:14][cH:15]2

Participants

5

Reactant 4

HCID 223AmmoniumHCID 283FormateHCID 702EthanolHCID 17981617HCID 17981617, compound

Product 1

HCID 17981682HCID 17981682, compound

Sources & evidence

ORD record
ord-89b2ba0135be415ea10f47ee21df2721
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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