| SpectraBase Spectrum ID |
7MW2hdFZ6sN |
| Name |
7-Chloro-3-[2,4-dichlorophenyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.977377311 u |
| Formula |
C19H11Cl3O3 |
| InChI |
InChI=1S/C19H11Cl3O3/c20-10-2-4-16-13(7-10)19(24)18-15(23)5-9(6-17(18)25-16)12-3-1-11(21)8-14(12)22/h1-4,7-9H,5-6H2 |
| InChIKey |
JJPPKWCXVIXWQK-UHFFFAOYSA-N |
| Molecular Weight |
393.653 g/mol |
| SMILES |
C12=C(C(C3=C(O2)CC(CC3=O)C2=C(C=C(C=C2)Cl)Cl)=O)C=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892845 |
![7-Chloro-3-[2,4-dichlorophenyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione](/api/spectrum/7MW2hdFZ6sN/structure.png?h=300&w=458 "7-Chloro-3-[2,4-dichlorophenyl]-3,4-dihydro-1H-xanthene-1,9(2H)-dione")
