| SpectraBase Spectrum ID |
EmRBWGIRfLh |
| Name |
4,8-Dichloro-1-anthraquinone carboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
319.964314069 u |
| Formula |
C15H6Cl2O4 |
| InChI |
InChI=1S/C15H6Cl2O4/c16-8-3-1-2-6-10(8)14(19)11-7(15(20)21)4-5-9(17)12(11)13(6)18/h1-5H,(H,20,21) |
| InChIKey |
RAESHMVMQQZDRC-UHFFFAOYSA-N |
| Molecular Weight |
321.115 g/mol |
| SMILES |
C12=C(C=CC=C2Cl)C(C=2C(C1=O)=C(C=CC2Cl)C(O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868547 |
