Ammonia → 2-(3-(1-Oxa-4,9-diazaspiro[5.5]undecan-9-ylmethyl)-2-fluorophenyl)ethanol

HRID 89689

Reaction equation

HRID 89689 reaction equation
[CH3:30][CH2:31][CH2:32][CH:33]([CH3:34])[CH3:35].[CH3:36][OH:37].[F:2][C:3]([F:4])([F:5])[C:28]([N:6]1[CH2:7][CH2:8][O:9][C:10]2([CH2:11]1)[CH2:12][CH2:13][N:14]([CH2:17][c:18]1[c:19]([F:27])[c:20]([CH2:24][CH2:25][OH:26])[cH:21][cH:22][cH:23]1)[CH2:15][CH2:16]2)=[O:29].[NH3:1]>>[NH:6]1[CH2:7][CH2:8][O:9][C:10]2([CH2:11]1)[CH2:12][CH2:13][N:14]([CH2:17][c:18]1[c:19]([F:27])[c:20]([CH2:24][CH2:25][OH:26])[cH:21][cH:22][cH:23]1)[CH2:15][CH2:16]2

Participants

5

Reactant 4

HCID 222AmmoniaHCID 887MethanolHCID 78922-MethylpentaneHCID 579893822,2,2-Trifluoro-1-(9-(2-fluoro-3-(2-hydroxyethyl)benzyl)-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)ethanone

Product 1

HCID 579891872-(3-(1-Oxa-4,9-diazaspiro[5.5]undecan-9-ylmethyl)-2-fluorophenyl)ethanol

Sources & evidence

ORD record
ord-ac102c3501a44201b49ba4b16c95d8de
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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