Ethanol → HCID 3389390, compound

HRID 2333372Notes

Reaction equation

HRID 2333372 reaction equation
[C:13](=[O:14])([OH:15])[O-:16].[CH3:32][CH2:33][OH:34].[N+:18](=[O:19])([O-:20])[c:21]1[c:22]([F:30])[cH:23][cH:24][c:25]([N+:27](=[O:28])[O-:29])[cH:26]1.[NH2:1][CH2:2][CH2:3][c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12.[Na+:17].[OH2:31]>>[NH:1]([CH2:2][CH2:3][c:4]1[cH:5][nH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]12)[c:22]1[c:21]([N+:18](=[O:19])[O-:20])[cH:26][c:25]([N+:27](=[O:28])[O-:29])[cH:24][cH:23]1

Participants

7

Reactant 6

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 1150TryptamineHCID 6264Dinitrofluorobenzene

Product 1

HCID 3389390HCID 3389390, compound

Sources & evidence

ORD record
ord-e26c622cb7ec49e2aaee7cde1fcc2d66
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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