| SpectraBase Spectrum ID |
GKDTDHt028T |
| Name |
2,5-Cyclohexadiene-1,4-dione, 2,3,5,6-tetraphenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.146329882 u |
| Formula |
C30H20O2 |
| InChI |
InChI=1S/C30H20O2/c31-29-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)30(32)28(24-19-11-4-12-20-24)27(29)23-17-9-3-10-18-23/h1-20H |
| InChIKey |
SDHAJQUQEHICIH-UHFFFAOYSA-N |
| Molecular Weight |
412.488 g/mol |
| SMILES |
C1=CC(C=2C(=O)C(C3=CC=CC=C3)=C(C3=CC=CC=C3)C(C2C2=CC=CC=C2)=O)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812009 |
