| SpectraBase Spectrum ID |
AC1HbKCxjDf |
| Name |
7-Hydroxy-4-phenylcoumarin, trifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.045293255 u |
| Formula |
C17H9F3O4 |
| InChI |
InChI=1S/C17H9F3O4/c18-17(19,20)16(22)23-11-6-7-12-13(10-4-2-1-3-5-10)9-15(21)24-14(12)8-11/h1-9H |
| InChIKey |
WBKASPFHGUDXLO-UHFFFAOYSA-N |
| Molecular Weight |
334.250 g/mol |
| SMILES |
C1=2OC(C=C(C2C=CC(=C1)OC(C(F)(F)F)=O)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931387 |
