| SpectraBase Compound ID | 9C4I7ZLpBUx |
|---|---|
| InChI | InChI=1S/C23H22O4/c1-2-3-8-16-26-22(24)19-13-6-7-14-20(19)23(25)27-21-15-9-11-17-10-4-5-12-18(17)21/h4-7,9-15H,2-3,8,16H2,1H3 |
| InChIKey | WCPHZAHEMDUKIF-UHFFFAOYSA-N |
| Mol Weight | 362.43 g/mol |
| Molecular Formula | C23H22O4 |
| Exact Mass | 362.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XFNjHoLhcV |
|---|---|
| Name | Phthalic acid, 1-naphthyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 362.151809184 u |
| Formula | C23H22O4 |
| InChI | InChI=1S/C23H22O4/c1-2-3-8-16-26-22(24)19-13-6-7-14-20(19)23(25)27-21-15-9-11-17-10-4-5-12-18(17)21/h4-7,9-15H,2-3,8,16H2,1H3 |
| InChIKey | WCPHZAHEMDUKIF-UHFFFAOYSA-N |
| Molecular Weight | 362.425 g/mol |
| SMILES | C(C1=C(C=CC=C1)C(=O)OCCCCC)(OC1=C2C(=CC=C1)C=CC=C2)=O |