SpectraBase Spectrum ID |
C8KOcSDekqg |
Name |
1,11-Diphenylundecane-1,11-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
336.208930140 u |
Formula |
C23H28O2 |
InChI |
InChI=1S/C23H28O2/c24-22(20-14-8-6-9-15-20)18-12-4-2-1-3-5-13-19-23(25)21-16-10-7-11-17-21/h6-11,14-17H,1-5,12-13,18-19H2 |
InChIKey |
VNTCLENFVSVECD-UHFFFAOYSA-N |
Molecular Weight |
336.475 g/mol |
SMILES |
C(=O)(CCCCCCCCCC(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823852 |