| SpectraBase Compound ID | tn4aqRy0Vw |
|---|---|
| InChI | InChI=1S/C18H14O2/c1-13-6-2-5-9-17(13)18(19)20-16-11-10-14-7-3-4-8-15(14)12-16/h2-12H,1H3 |
| InChIKey | LJIQFSNCVVGXSR-UHFFFAOYSA-N |
| Mol Weight | 262.31 g/mol |
| Molecular Formula | C18H14O2 |
| Exact Mass | 262.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2mxaFZ6BIO2 |
|---|---|
| Name | o-Toluic acid, 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.099379689 u |
| Formula | C18H14O2 |
| InChI | InChI=1S/C18H14O2/c1-13-6-2-5-9-17(13)18(19)20-16-11-10-14-7-3-4-8-15(14)12-16/h2-12H,1H3 |
| InChIKey | LJIQFSNCVVGXSR-UHFFFAOYSA-N |
| Molecular Weight | 262.308 g/mol |
| SMILES | C1=CC=CC(=C1C)C(OC1=CC=C2C=CC=CC2=C1)=O |