| SpectraBase Spectrum ID |
2LmYfXRD0rH |
| Name |
2,7-bis[2'-(4''-Methoxyphenyl)ethyl]-9H-fluoren-9-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.203844759 u |
| Formula |
C31H28O3 |
| InChI |
InChI=1S/C31H28O3/c1-33-25-13-7-21(8-14-25)3-5-23-11-17-27-28-18-12-24(20-30(28)31(32)29(27)19-23)6-4-22-9-15-26(34-2)16-10-22/h7-20H,3-6H2,1-2H3 |
| InChIKey |
YSLNQGNGBMPXFP-UHFFFAOYSA-N |
| Molecular Weight |
448.562 g/mol |
| SMILES |
C=12C(C=3C=C(CCC=4C=CC(=CC4)OC)C=CC3C1C=CC(=C2)CCC=1C=CC(=CC1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914259 |
![2,7-bis[2'-(4''-Methoxyphenyl)ethyl]-9H-fluoren-9-one](/api/spectrum/2LmYfXRD0rH/structure.png?h=300&w=458 "2,7-bis[2'-(4''-Methoxyphenyl)ethyl]-9H-fluoren-9-one")
