| SpectraBase Compound ID | BXIiYnhWoZ7 |
|---|---|
| InChI | InChI=1S/C22H20O4/c1-2-3-14-25-21(23)19-10-6-7-11-20(19)22(24)26-18-13-12-16-8-4-5-9-17(16)15-18/h4-13,15H,2-3,14H2,1H3 |
| InChIKey | NDOUVNQOYGSNPX-UHFFFAOYSA-N |
| Mol Weight | 348.4 g/mol |
| Molecular Formula | C22H20O4 |
| Exact Mass | 348.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6aTvTMeqpCP |
|---|---|
| Name | Phthalic acid, butyl 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.136159120 u |
| Formula | C22H20O4 |
| InChI | InChI=1S/C22H20O4/c1-2-3-14-25-21(23)19-10-6-7-11-20(19)22(24)26-18-13-12-16-8-4-5-9-17(16)15-18/h4-13,15H,2-3,14H2,1H3 |
| InChIKey | NDOUVNQOYGSNPX-UHFFFAOYSA-N |
| Molecular Weight | 348.398 g/mol |
| SMILES | CCCCOC(C1=CC=CC=C1C(OC=1C=CC2=CC=CC=C2C1)=O)=O |