| SpectraBase Spectrum ID |
G1WCVyn5ndB |
| Name |
2',6'-Diphenylspiro(4,7-dyphenylindane-2,1'-cyclohexane)-1,3,4'-trione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
532.203844759 u |
| Formula |
C38H28O3 |
| InChI |
InChI=1S/C38H28O3/c39-29-23-32(27-17-9-3-10-18-27)38(33(24-29)28-19-11-4-12-20-28)36(40)34-30(25-13-5-1-6-14-25)21-22-31(35(34)37(38)41)26-15-7-2-8-16-26/h1-22,32-33H,23-24H2 |
| InChIKey |
GSLKHEAGSVAAEG-UHFFFAOYSA-N |
| Molecular Weight |
532.639 g/mol |
| SMILES |
C1=CC=C(C=C1)C1=C2C(=O)C3(C(C4=CC=CC=C4)CC(CC3C3=CC=CC=C3)=O)C(C2=C(C=C1)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858101 |
