| SpectraBase Compound ID | HPLdt4bRqWb |
|---|---|
| InChI | InChI=1S/C16H12O/c1-11(17)13-7-4-8-15-14-6-3-2-5-12(14)9-10-16(13)15/h2-10H,1H3 |
| InChIKey | FFNRKAWQIXXMNB-UHFFFAOYSA-N |
| Mol Weight | 220.27 g/mol |
| Molecular Formula | C16H12O |
| Exact Mass | 220.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G07HsW36etC |
|---|---|
| Name | 3-Acetylphenanthrene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.088815005 u |
| Formula | C16H12O |
| InChI | InChI=1S/C16H12O/c1-11(17)13-7-4-8-15-14-6-3-2-5-12(14)9-10-16(13)15/h2-10H,1H3 |
| InChIKey | FFNRKAWQIXXMNB-UHFFFAOYSA-N |
| Molecular Weight | 220.271 g/mol |
| SMILES | c1ccc2c3cccc(c3ccc2c1)C(=O)C |