| SpectraBase Compound ID | 2EdQImg2ZsI |
|---|---|
| InChI | InChI=1S/C18H11NO2/c19-12-13-8-10-15(11-9-13)21-18(20)17-7-3-5-14-4-1-2-6-16(14)17/h1-11H |
| InChIKey | XJZYDLZARKPZFG-UHFFFAOYSA-N |
| Mol Weight | 273.29 g/mol |
| Molecular Formula | C18H11NO2 |
| Exact Mass | 273.078979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FmOBart4fag |
|---|---|
| Name | 1-Naphthoic acid, 4-cyanophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.078978596 u |
| Formula | C18H11NO2 |
| InChI | InChI=1S/C18H11NO2/c19-12-13-8-10-15(11-9-13)21-18(20)17-7-3-5-14-4-1-2-6-16(14)17/h1-11H |
| InChIKey | XJZYDLZARKPZFG-UHFFFAOYSA-N |
| SMILES | C1=CC2=C(C(=C1)C(OC=1C=CC(C#N)=CC1)=O)C=CC=C2 |