| SpectraBase Spectrum ID |
HLkYLumbbwJ |
| Name |
1,3-bis(4-Methylbenzoyl)benzene; methanone, 1,3-phenylenebis[(4-methylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.130679818 u |
| Formula |
C22H18O2 |
| InChI |
InChI=1S/C22H18O2/c1-15-6-10-17(11-7-15)21(23)19-4-3-5-20(14-19)22(24)18-12-8-16(2)9-13-18/h3-14H,1-2H3 |
| InChIKey |
FIALLYBQVILKOF-UHFFFAOYSA-N |
| SMILES |
C1(=CC=C(C=C1)C)C(C1=CC(=CC=C1)C(C1=CC=C(C=C1)C)=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.913087 |
