SpectraBase Spectrum ID |
CfLOoSzYdl |
Name |
5,6,7-Trimethoxy-2-phenyl-8-(5,6,7-trimethoxy-4-oxidanylidene-2-phenyl-chromen-8-yl)chromen-4-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
622.183897156 u |
Formula |
C36H30O10 |
InChI |
InChI=1S/C36H30O10/c1-39-31-25-21(37)17-23(19-13-9-7-10-14-19)45-29(25)27(33(41-3)35(31)43-5)28-30-26(32(40-2)36(44-6)34(28)42-4)22(38)18-24(46-30)20-15-11-8-12-16-20/h7-18H,1-6H3 |
InChIKey |
INMSEIKPXHQPPA-UHFFFAOYSA-N |
Molecular Weight |
622.626 g/mol |
SMILES |
C=1(C=2C3=C(C(OC)=C(C2OC)OC)C(=O)C=C(O3)C=2C=CC=CC2)C2=C(C(=O)C=C(O2)C=2C=CC=CC2)C(=C(C1OC)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867319 |