SpectraBase Spectrum ID |
8jUY1MiOiDh |
Name |
[2-(2-Benzoyl-4-methoxy-phenyl)-5-methoxy-phenyl]-phenyl-methanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
422.151809184 u |
Formula |
C28H22O4 |
InChI |
InChI=1S/C28H22O4/c1-31-21-13-15-23(25(17-21)27(29)19-9-5-3-6-10-19)24-16-14-22(32-2)18-26(24)28(30)20-11-7-4-8-12-20/h3-18H,1-2H3 |
InChIKey |
HFUWYOYTKIAAIZ-UHFFFAOYSA-N |
Molecular Weight |
422.480 g/mol |
SMILES |
C=1(C(C=2C(C(=O)C=3C=CC=CC3)=CC(=CC2)OC)=CC=C(C1)OC)C(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887164 |