| SpectraBase Compound ID | IErEVzDMTn |
|---|---|
| InChI | InChI=1S/C15H16O2/c1-3-11(2)17-15(16)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,3H2,1-2H3 |
| InChIKey | IKPYWNAGDGGNRE-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 | 6j7kE7b8Pjv |
|---|---|
| Name | 1-Naphthalenecarboxylic acid 2-butyl 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/c1-3-11(2)17-15(16)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,3H2,1-2H3 |
| InChIKey | IKPYWNAGDGGNRE-UHFFFAOYSA-N |
| Molecular Weight | 228.291 g/mol |
| SMILES | C=12C(C(OC(CC)C)=O)=CC=CC2=CC=CC1 |