Water → Bromide ion

HRID 99195

Reaction equation

HRID 99195 reaction equation
[Br:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH2:11]1[CH2:12][CH2:13][S:14][CH2:15]1.[CH3:17][CH2:18][O:19][CH2:20][CH3:21].[N+:22]([CH3:23])([O-:24])=[O:25].[OH2:16]>>[Br-:1].[CH2:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[S+:14]1[CH2:13][CH2:12][CH2:11][CH2:15]1

Participants

7

Reactant 5

HCID 962WaterHCID 1127TetrahydrothiopheneHCID 3283Diethyl EtherHCID 6259Phenacyl bromideHCID 6375Nitromethane

Product 2

HCID 259Bromide ionHCID 37740611-(2-Oxo-2-phenylethyl)tetrahydrothiophenium

Sources & evidence

ORD record
ord-d85890a148e84e308efef9db51214949
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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