| SpectraBase Spectrum ID |
KtePd7H9DAu |
| Name |
11,12-Dihydrobenzo[J]fluoranthene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
254.109550451 u |
| Formula |
C20H14 |
| InChI |
InChI=1S/C20H14/c1-2-8-15-13(5-1)11-12-17-16-9-3-6-14-7-4-10-18(19(14)16)20(15)17/h1-10H,11-12H2 |
| InChIKey |
WRKHCDMISIKSSW-UHFFFAOYSA-N |
| Molecular Weight |
254.332 g/mol |
| SMILES |
C12=C(C3=CC=CC=4C3=C2C=CC4)CCC=2C1=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87232 |