| SpectraBase Spectrum ID |
Egc2v1r2vch |
| Name |
(1-Acetoxy-9,10-dimethyl-5,6-dioxo-2-anthryl) acetate |
| 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/c1-9-14-6-8-16(25-11(3)21)20(26-12(4)22)18(14)10(2)13-5-7-15(23)19(24)17(9)13/h5-8H,1-4H3 |
| InChIKey |
SPTGRHIMDBSJJA-UHFFFAOYSA-N |
| Molecular Weight |
352.342 g/mol |
| SMILES |
C1(C(C=CC=2C(=C3C(=C(C=CC3=C(C12)C)OC(=O)C)OC(=O)C)C)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921852 |
