| SpectraBase Spectrum ID |
DU0rTSK44HT |
| Name |
2,3-bis(Chloranyl)-1,4-bis(oxidanyl)anthracene-9,10-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.964314069 u |
| Formula |
C14H6Cl2O4 |
| InChI |
InChI=1S/C14H6Cl2O4/c15-9-10(16)14(20)8-7(13(9)19)11(17)5-3-1-2-4-6(5)12(8)18/h1-4,19-20H |
| InChIKey |
LZUADSKQLOWGDZ-UHFFFAOYSA-N |
| Molecular Weight |
309.104 g/mol |
| SMILES |
C=12C(C(=O)C3=C(C2=O)C=CC=C3)=C(O)C(=C(C1O)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866345 |
