Methanol → HCID 73882372, compound

HRID 125698

Reaction equation

HRID 125698 reaction equation
[C:46]([O:47][CH2:48][CH3:49])(=[O:50])[CH3:51].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:13]([CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])=[O:21])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12.[CH3:31][O:32][C:33]([CH3:34])([CH3:35])[CH3:36].[CH3:37][OH:38].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[N:27](=[O:28])[O-:29].[Na+:30].[OH2:39].[S:22](=[O:23])(=[O:24])([OH:25])[OH:26]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:13]([C:14]([CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])=[N:27][OH:28])=[O:21])[c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12

Participants

10

Reactant 9

HCID 887MethanolHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 1118Sulfuric AcidHCID 8058HexaneHCID 8857Ethyl AcetateHCID 15413tert-Butyl methyl etherHCID 223208401-(4-Methoxynaphthyl)-octan-1-one

Product 1

HCID 73882372HCID 73882372, compound

Sources & evidence

ORD record
ord-67dcffbb8fa3401c9ea71452b6b42df8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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