![Benzo[j]fluoranthene](/api/spectrum/4EZYygC1iyn/structure.png?h=300&w=458 "Benzo[j]fluoranthene")
| SpectraBase Compound ID | Ez4SIL8pEDd |
|---|---|
| InChI | InChI=1S/C20H12/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/h1-12H |
| InChIKey | KHNYNFUTFKJLDD-UHFFFAOYSA-N |
| Mol Weight | 252.32 g/mol |
| Molecular Formula | C20H12 |
| Exact Mass | 252.0939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4EZYygC1iyn |
|---|---|
| Name | Benzo[J]fluoranthene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.093900386 u |
| Formula | C20H12 |
| InChI | InChI=1S/C20H12/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/h1-12H |
| InChIKey | KHNYNFUTFKJLDD-UHFFFAOYSA-N |
| Molecular Weight | 252.316 g/mol |
| SMILES | C1=CC=2C3=C(C4=C(C=C3)C=CC=C4)C=3C2C(=C1)C=CC3 |