| SpectraBase Spectrum ID |
BW4CSO2iU7D |
| Name |
3-(4-Fluorophenyl)-1-methyl-1H-benzo[G]isochromene-5,10-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.084872439 u |
| Formula |
C20H13FO3 |
| InChI |
InChI=1S/C20H13FO3/c1-11-18-16(10-17(24-11)12-6-8-13(21)9-7-12)19(22)14-4-2-3-5-15(14)20(18)23/h2-11H,1H3 |
| InChIKey |
YXDTZHBKWGOTPW-UHFFFAOYSA-N |
| Molecular Weight |
320.319 g/mol |
| SMILES |
C1(C2=C(C=C(O1)C=1C=CC(=CC1)F)C(C=1C=CC=CC1C2=O)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862319 |
![3-(4-fluorophenyl)-1-methyl-1H-benzo[g]isochromene-5,10-dione](/api/spectrum/BW4CSO2iU7D/structure.png?h=300&w=458 "3-(4-fluorophenyl)-1-methyl-1H-benzo[g]isochromene-5,10-dione")
