| SpectraBase Compound ID | alSudWwfQt |
|---|---|
| InChI | InChI=1S/C16H14O2/c1-3-12(2)18-16(17)11-14-9-6-8-13-7-4-5-10-15(13)14/h1,4-10,12H,11H2,2H3 |
| InChIKey | RSKPBRCHCWXUPN-UHFFFAOYSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C16H14O2 |
| Exact Mass | 238.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CpTfzSOuaGo |
|---|---|
| Name | 1-Naphthaleneacetic acid, but-3-yn-2-yl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.099379689 u |
| Formula | C16H14O2 |
| InChI | InChI=1S/C16H14O2/c1-3-12(2)18-16(17)11-14-9-6-8-13-7-4-5-10-15(13)14/h1,4-10,12H,11H2,2H3 |
| InChIKey | RSKPBRCHCWXUPN-UHFFFAOYSA-N |
| Molecular Weight | 238.286 g/mol |
| SMILES | C1=CC2=C(C=C1)C(=CC=C2)CC(=O)OC(C#C)C |