| SpectraBase Compound ID | 89K8ynEvaGa |
|---|---|
| InChI | InChI=1S/C15H16O2/c1-11(2)10-17-15(16)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11H,10H2,1-2H3 |
| InChIKey | XSXVDOHCUGQVBJ-UHFFFAOYSA-N |
| Mol Weight | 228.29 g/mol |
| Molecular Formula | C15H16O2 |
| Exact Mass | 228.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3L8eXYGTrIB |
|---|---|
| Name | 2-Naphthalenecarboxylic acid isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.115029753 u |
| Formula | C15H16O2 |
| InChI | InChI=1S/C15H16O2/c1-11(2)10-17-15(16)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11H,10H2,1-2H3 |
| InChIKey | XSXVDOHCUGQVBJ-UHFFFAOYSA-N |
| Molecular Weight | 228.291 g/mol |
| SMILES | C=12C(C=CC(=C2)C(OCC(C)C)=O)=CC=CC1 |