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 |