| SpectraBase Spectrum ID |
2sHejTzNMkA |
| Name |
2,3-Dimethylquinizarin, diacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.094688229 u |
| Formula |
C20H16O6 |
| InChI |
InChI=1S/C20H16O6/c1-9-10(2)20(26-12(4)22)16-15(19(9)25-11(3)21)17(23)13-7-5-6-8-14(13)18(16)24/h5-8H,1-4H3 |
| InChIKey |
UWKQAWHYVVNDRJ-UHFFFAOYSA-N |
| Molecular Weight |
352.342 g/mol |
| SMILES |
C1(OC(C)=O)=C2C(=C(C(=C1C)C)OC(C)=O)C(=O)C=1C(C2=O)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882657 |
