Ammonium → HCID 66747768, compound

HRID 126268

Reaction equation

[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:22][c:23]1[cH:24][cH:25][c:26]([S:27]([O:28][CH2:33][C:34]([F:35])([F:36])[F:37])(=[O:29])=[O:30])[cH:31][cH:32]1.[CH3:40][S:41]([CH3:42])=[O:43].[Cl-:38].[H-:1].[NH2:3][c:4]1[n:5][cH:6][cH:7][cH:8][c:9]1[O:10][c:11]1[cH:12][cH:13][c:14]2[cH:15][cH:16][c:17]([OH:21])[cH:18][c:19]2[cH:20]1.[NH4+:39].[Na+:2]>>[NH2:3][c:4]1[n:5][cH:6][cH:7][cH:8][c:9]1[O:10][c:11]1[cH:12][cH:13][c:14]2[cH:15][cH:16][c:17]([O:21][CH2:33][C:34]([F:35])([F:36])[F:37])[cH:18][c:19]2[cH:20]1

Participants

Reactant 8

HCID 223Ammonium

HCID 312Chloride

HCID 679Dimethyl Sulfoxide

HCID 923Sodium ion

HCID 8028Tetrahydrofuran

HCID 67942Ethanol, 2,2,2-trifluoro-, 1-(4-methylbenzenesulfonate)

HCID 166653Hydride

HCID 66747765HCID 66747765, compound

Product 1

HCID 66747768HCID 66747768, compound

Sources & evidence

ORD record: ord-13e897ab9eaa4165974880cb311b462a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Linked notes

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