| SpectraBase Compound ID | Apqw5kRerJa |
|---|---|
| InChI | InChI=1S/C17H14O2/c1-11(17(18)19)16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-11H,1H3,(H,18,19) |
| InChIKey | KDSPHRIFRARIST-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C17H14O2 |
| Exact Mass | 250.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FBdpLwn4xXk |
|---|---|
| Name | 2-(9-Phenanthryl)propanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.099379689 u |
| Formula | C17H14O2 |
| InChI | InChI=1S/C17H14O2/c1-11(17(18)19)16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-11H,1H3,(H,18,19) |
| InChIKey | KDSPHRIFRARIST-UHFFFAOYSA-N |
| Molecular Weight | 250.297 g/mol |
| SMILES | C=1(C=2C(=CC=CC2)C=2C(C1)=CC=CC2)C(C(=O)O)C |