| SpectraBase Spectrum ID |
giqr5z5hT2 |
| Name |
4(5)-Phenylcyclopentadieno-9,10-phenanthrene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.125200515 u |
| Formula |
C23H16 |
| InChI |
InChI=1S/C23H16/c1-2-8-16(9-3-1)17-12-6-14-21-19-11-5-4-10-18(19)20-13-7-15-22(20)23(17)21/h1-6,8-15H,7H2 |
| InChIKey |
JTJXOGXJJQDRED-UHFFFAOYSA-N |
| Molecular Weight |
292.381 g/mol |
| SMILES |
C=12C=3C(=CC=CC3C3=CC=CC=C3)C=3C(C2=CCC1)=CC=CC3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906724 |
