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(2S)-1-(2-fluorophenyl)-2-hydroxy-1-propanone
SpectraBase Compound ID IiORE4Bzgwu
InChI InChI=1S/C9H9FO2/c1-6(11)9(12)7-4-2-3-5-8(7)10/h2-6,11H,1H3/t6-/m0/s1
InChIKey ARCUIEFXWVXXPS-LURJTMIESA-N
Mol Weight 168.17 g/mol
Molecular Formula C9H9FO2
Exact Mass 168.058658 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID F0pBXzsylpr
Name (2S)-1-(2-Fluorophenyl)-2-hydroxy-1-propanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.058657691 u
Formula C9H9FO2
InChI InChI=1S/C9H9FO2/c1-6(11)9(12)7-4-2-3-5-8(7)10/h2-6,11H,1H3/t6-/m0/s1
InChIKey ARCUIEFXWVXXPS-LURJTMIESA-N
Molecular Weight 168.167 g/mol
SMILES C=1(C(=O)[C@@](O)(C)[H])C(F)=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.895325