![4-Chlorobenz[A]anthracene-7,12-dione](/api/spectrum/2fTJZInhRXb/structure.png?h=300&w=458 "4-Chlorobenz[A]anthracene-7,12-dione")
| SpectraBase Compound ID | 3ffTToTGVji |
|---|---|
| InChI | InChI=1S/C18H9ClO2/c19-15-7-3-6-11-10(15)8-9-14-16(11)18(21)13-5-2-1-4-12(13)17(14)20/h1-9H |
| InChIKey | PALLEFVKVDFKRX-UHFFFAOYSA-N |
| Mol Weight | 292.72 g/mol |
| Molecular Formula | C18H9ClO2 |
| Exact Mass | 292.029107 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2fTJZInhRXb |
|---|---|
| Name | 4-Chlorobenz[A]anthracene-7,12-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.029107228 u |
| Formula | C18H9ClO2 |
| InChI | InChI=1S/C18H9ClO2/c19-15-7-3-6-11-10(15)8-9-14-16(11)18(21)13-5-2-1-4-12(13)17(14)20/h1-9H |
| InChIKey | PALLEFVKVDFKRX-UHFFFAOYSA-N |
| SMILES | C=12C=CC=CC1C(C=1C=CC=3C(=CC=CC3C1C2=O)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.704588 |