| SpectraBase Compound ID | 2OzyTEYIdCx |
|---|---|
| InChI | InChI=1S/C22H20O4/c1-15(2)14-25-21(23)19-9-5-6-10-20(19)22(24)26-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15H,14H2,1-2H3 |
| InChIKey | JCZWKIKQZQRCSI-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 | HoWoPGtSTKN |
|---|---|
| Name | Phthalic acid, isobutyl 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/c1-15(2)14-25-21(23)19-9-5-6-10-20(19)22(24)26-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15H,14H2,1-2H3 |
| InChIKey | JCZWKIKQZQRCSI-UHFFFAOYSA-N |
| Molecular Weight | 348.398 g/mol |
| SMILES | CC(C)COC(C1=CC=CC=C1C(OC=1C=CC2=CC=CC=C2C1)=O)=O |