| SpectraBase Spectrum ID |
7V8RhRt8t06 |
| Name |
bis[4-(3,4,5-Trihydroxyphenoxy)phenyl]methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
462.095082151 u |
| Formula |
C25H18O9 |
| InChI |
InChI=1S/C25H18O9/c26-19-9-17(10-20(27)24(19)31)33-15-5-1-13(2-6-15)23(30)14-3-7-16(8-4-14)34-18-11-21(28)25(32)22(29)12-18/h1-12,26-29,31-32H |
| InChIKey |
MXWVOMMJMVBVTM-UHFFFAOYSA-N |
| Molecular Weight |
462.410 g/mol |
| SMILES |
C1(=C(C=C(OC=2C=CC(C(C=3C=CC(OC4=CC(=C(O)C(=C4)O)O)=CC3)=O)=CC2)C=C1O)O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967782 |
![bis[4-(3,4,5-Trihydroxyphenoxy)phenyl]methanone](/api/spectrum/7V8RhRt8t06/structure.png?h=300&w=458 "bis[4-(3,4,5-Trihydroxyphenoxy)phenyl]methanone")
