SpectraBase Spectrum ID |
7htHvgadOU |
Name |
3-(2-Fluorophenoxy)-7-hydroxy-4H-chromen-4-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
272.048486929 u |
Formula |
C15H9FO4 |
InChI |
InChI=1S/C15H9FO4/c16-11-3-1-2-4-12(11)20-14-8-19-13-7-9(17)5-6-10(13)15(14)18/h1-8,17H |
InChIKey |
HRRFNGSXGVNKIR-UHFFFAOYSA-N |
Molecular Weight |
272.231 g/mol |
SMILES |
C1(F)=C(C=CC=C1)OC1=COC2=C(C1=O)C=CC(=C2)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974017 |