| SpectraBase Spectrum ID |
AZvjos2IGBj |
| Name |
1-Methyl-3-(4-methylphenyl)-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 |
316.109944372 u |
| Formula |
C21H16O3 |
| InChI |
InChI=1S/C21H16O3/c1-12-7-9-14(10-8-12)18-11-17-19(13(2)24-18)21(23)16-6-4-3-5-15(16)20(17)22/h3-11,13H,1-2H3 |
| InChIKey |
RGXIWUPIQNDUNG-UHFFFAOYSA-N |
| Molecular Weight |
316.356 g/mol |
| SMILES |
C1(C2=C(C=C(O1)C=1C=CC(=CC1)C)C(C=1C=CC=CC1C2=O)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865678 |
![1-Methyl-3-(4-methylphenyl)-1H-benzo[g]isochromene-5,10-dione](/api/spectrum/AZvjos2IGBj/structure.png?h=300&w=458 "1-Methyl-3-(4-methylphenyl)-1H-benzo[g]isochromene-5,10-dione")
