| SpectraBase Spectrum ID |
1LInhwV24ei |
| Name |
7-Hydroxy-3-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)23-12-7-6-11-8-13(10-4-2-1-3-5-10)15(21)24-14(11)9-12/h1-9H |
| InChIKey |
ZGOYUUJQOXYFOL-UHFFFAOYSA-N |
| Molecular Weight |
334.250 g/mol |
| SMILES |
C1(=CC=CC=C1)C1=CC2=CC=C(C=C2OC1=O)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919458 |
