| SpectraBase Spectrum ID |
KWFaIzydZ0E |
| Name |
2-(4-Methoxy-3-oxidanyl-phenyl)-5-oxidanyl-7-phenylmethoxy-3-(3,4,5-trimethoxyphenyl)chromen-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
556.173332473 u |
| Formula |
C32H28O9 |
| InChI |
InChI=1S/C32H28O9/c1-36-24-11-10-19(12-22(24)33)31-28(20-13-26(37-2)32(39-4)27(14-20)38-3)30(35)29-23(34)15-21(16-25(29)41-31)40-17-18-8-6-5-7-9-18/h5-16,33-34H,17H2,1-4H3 |
| InChIKey |
RMVLXQOWXDUKKL-UHFFFAOYSA-N |
| Molecular Weight |
556.567 g/mol |
| SMILES |
C1(=C(OC2=C(C1=O)C(=CC(OCC=1C=CC=CC1)=C2)O)C=1C=C(O)C(=CC1)OC)C=1C=C(OC)C(=C(C1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864732 |
