| SpectraBase Compound ID | A3ccvj8zS89 |
|---|---|
| InChI | InChI=1S/C14H14O2/c1-2-9-16-14(15)13-8-7-11-5-3-4-6-12(11)10-13/h3-8,10H,2,9H2,1H3 |
| InChIKey | MFRMBQHDIJOTNW-UHFFFAOYSA-N |
| Mol Weight | 214.26 g/mol |
| Molecular Formula | C14H14O2 |
| Exact Mass | 214.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3NJxq5VoDAq |
|---|---|
| Name | 2-Naphthalenecarboxylic acid propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.099379689 u |
| Formula | C14H14O2 |
| InChI | InChI=1S/C14H14O2/c1-2-9-16-14(15)13-8-7-11-5-3-4-6-12(11)10-13/h3-8,10H,2,9H2,1H3 |
| InChIKey | MFRMBQHDIJOTNW-UHFFFAOYSA-N |
| Molecular Weight | 214.264 g/mol |
| SMILES | C=12C(C=CC(=C2)C(OCCC)=O)=CC=CC1 |