| SpectraBase Compound ID | 3BSn62DpYNK |
|---|---|
| InChI | InChI=1S/C13H8O2/c14-13(15)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,(H,14,15) |
| InChIKey | AAFMEUUZRXLGAY-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C13H8O2 |
| Exact Mass | 196.052429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Xa0GIjaGFX |
|---|---|
| Name | Naphthalen-1-yl-propynoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.052429496 u |
| Formula | C13H8O2 |
| InChI | InChI=1S/C13H8O2/c14-13(15)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,(H,14,15) |
| InChIKey | AAFMEUUZRXLGAY-UHFFFAOYSA-N |
| Molecular Weight | 196.205 g/mol |
| SMILES | C(#CC(=O)O)C1=C2C(C=CC=C2)=CC=C1 |