Ammonia → HCID 178451355, compound

HRID 162500Notes

Reaction equation

HRID 162500 reaction equation
[C:1](=[O:2])([CH3:3])[O:4][CH:5]([C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([N+:21](=[O:22])[O-:23])[cH:19][cH:20]1.[C:27]([O:28][CH2:29][CH3:30])(=[O:31])[CH3:32].[CH3:24][OH:25].[NH3:26].[c:33]1([CH3:34])[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[OH:4][CH:5]([C:6](=[O:7])[O:8][C:9]([CH3:10])([CH3:11])[CH3:12])[CH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([N+:21](=[O:22])[O-:23])[cH:19][cH:20]1

Participants

6

Reactant 5

HCID 222AmmoniaHCID 887MethanolHCID 1140TolueneHCID 8857Ethyl AcetateHCID 178476206HCID 178476206, compound

Product 1

HCID 178451355HCID 178451355, compound

Sources & evidence

ORD record
ord-7e3fb8b4f4104bef958ede59f8856f0a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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