| SpectraBase Compound ID | 5LGF1AeUttz |
|---|---|
| InChI | InChI=1S/C19H14O/c20-19(15-5-2-1-3-6-15)17-12-11-14-10-9-13-7-4-8-16(17)18(13)14/h1-8,11-12H,9-10H2 |
| InChIKey | YQRRSORFUCNQAC-UHFFFAOYSA-N |
| Mol Weight | 258.32 g/mol |
| Molecular Formula | C19H14O |
| Exact Mass | 258.104465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JZGs6CENLTC |
|---|---|
| Name | Acenaphthene, 5-benzoyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.104465070 u |
| Formula | C19H14O |
| InChI | InChI=1S/C19H14O/c20-19(15-5-2-1-3-6-15)17-12-11-14-10-9-13-7-4-8-16(17)18(13)14/h1-8,11-12H,9-10H2 |
| InChIKey | YQRRSORFUCNQAC-UHFFFAOYSA-N |
| Molecular Weight | 258.320 g/mol |
| SMILES | C1(=C2C=3C(CCC3C=C1)=CC=C2)C(=O)C=1C=CC=CC1 |