SpectraBase Spectrum ID |
6eK14aIrixn |
Name |
1,5-Dimethoxy-2,6-bis(prop-2'-enyl)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/c1-5-7-13-9-11-15-17(21(13)25-3)19(23)16-12-10-14(8-6-2)22(26-4)18(16)20(15)24/h5-6,9-12H,1-2,7-8H2,3-4H3 |
InChIKey |
NMQZUKKUGRJIHN-UHFFFAOYSA-N |
Molecular Weight |
348.398 g/mol |
SMILES |
C=12C(C=3C=CC(=C(C3C(C2=CC=C(C1OC)CC=C)=O)OC)CC=C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85606 |