Acetic Acid → HCID 501116, compound

HRID 287832Notes

Reaction equation

HRID 287832 reaction equation
[C:23]([O:24][OH:26])(=[O:25])[CH3:27].[CH3:28][C:29](=[O:30])[OH:31].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:13][S:14](=[O:15])[c:16]2[n+:17]([O-:22])[cH:18][cH:19][cH:20][cH:21]2)[cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:13][S:14](=[O:15])([c:16]2[n+:17]([O-:22])[cH:18][cH:19][cH:20][cH:21]2)=[O:25])[cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 6585Peracetic AcidHCID 18377461HCID 18377461, compound

Product 1

HCID 501116HCID 501116, compound

Sources & evidence

ORD record
ord-c5ab295a37194eb28f9e84924bfae2eb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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