| SpectraBase Spectrum ID |
IICRdegf102 |
| Name |
1-Hydroxy-2-(2'-methylprop-2'-enyl)-5-(2''-methylprop-2''enyloxy)-anthraquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.136159120 u |
| Formula |
C22H20O4 |
| InChI |
InChI=1S/C22H20O4/c1-12(2)10-14-8-9-16-19(20(14)23)22(25)15-6-5-7-17(18(15)21(16)24)26-11-13(3)4/h5-9,23H,1,3,10-11H2,2,4H3 |
| InChIKey |
CIQBEFLJEJVAKB-UHFFFAOYSA-N |
| Molecular Weight |
348.398 g/mol |
| SMILES |
C1(=O)C2=C(C(C3=C(OCC(=C)C)C=CC=C13)=O)C=CC(=C2O)CC(=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862949 |
