| SpectraBase Spectrum ID |
Gp7ebv44Qpt |
| Name |
4-(2-Fluorostyryl)-6-fluorocoumarin dimer |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
568.129771772 u |
| Formula |
C34H20F4O4 |
| InChI |
InChI=1S/C34H20F4O4/c35-17-9-11-27-21(13-17)23(15-29(39)41-27)33-31(19-5-1-3-7-25(19)37)32(20-6-2-4-8-26(20)38)34(33)24-16-30(40)42-28-12-10-18(36)14-22(24)28/h1-16,31-34H |
| InChIKey |
STYVOXUVPSMYAO-UHFFFAOYSA-N |
| Molecular Weight |
568.524 g/mol |
| SMILES |
C=1(C2C(C=3C=4C(=CC=C(C4)F)OC(C3)=O)C(C2C=2C(F)=CC=CC2)C=2C(F)=CC=CC2)C=2C(=CC=C(C2)F)OC(C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.888452 |
