| SpectraBase Compound ID | FZhQ6DsV6RF |
|---|---|
| InChI | InChI=1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H |
| InChIKey | GUEIZVNYDFNHJU-UHFFFAOYSA-N |
| Mol Weight | 240.21 g/mol |
| Molecular Formula | C14H8O4 |
| Exact Mass | 240.042259 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BVNy23EoFC1 |
|---|---|
| Name | Quinizarin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.042258734 u |
| Formula | C14H8O4 |
| InChI | InChI=1S/C14H8O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-16H |
| InChIKey | GUEIZVNYDFNHJU-UHFFFAOYSA-N |
| Molecular Weight | 240.214 g/mol |
| SMILES | OC1=CC=C(C=2C(C=3C=CC=CC3C(C12)=O)=O)O |
| Spectrum/Structure Validation Score (Raman) | 0.911941 |