1-Butanol → HCID 12281154, compound

Reaction equation

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([O:24][CH2:25][CH3:26])[c:11]2[c:12]([n:13][cH:14]1)[n:15]([CH2:18][c:19]1[o:20][cH:21][cH:22][cH:23]1)[n:16][cH:17]2.[CH2:33]([OH:34])[CH2:35][CH2:36][CH3:37].[OH2:32].[S:27](=[O:28])(=[O:29])([OH:30])[OH:31]>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([O:24][CH2:25][CH3:26])[c:11]2[c:12]([n:13][cH:14]1)[nH:15][n:16][cH:17]2

Participants

Reactant 4

HCID 2631-Butanol

HCID 962Water

HCID 1118Sulfuric Acid

HCID 12281144HCID 12281144, compound

Product 1

HCID 12281154HCID 12281154, compound

Sources & evidence

ORD record: ord-dcf4de475d764c1bbfb35cd1911f7f32
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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