| SpectraBase Compound ID | B3HGwP9WRrg |
|---|---|
| InChI | InChI=1S/C19H22O4/c1-2-13-22-18(20)9-5-6-10-19(21)23-17-12-11-15-7-3-4-8-16(15)14-17/h3-4,7-8,11-12,14H,2,5-6,9-10,13H2,1H3 |
| InChIKey | IIRYCPJHFVZVMO-UHFFFAOYSA-N |
| Mol Weight | 314.38 g/mol |
| Molecular Formula | C19H22O4 |
| Exact Mass | 314.151809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7xsTmJ2rLra |
|---|---|
| Name | Adipic acid, 2-naphthyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.151809184 u |
| Formula | C19H22O4 |
| InChI | InChI=1S/C19H22O4/c1-2-13-22-18(20)9-5-6-10-19(21)23-17-12-11-15-7-3-4-8-16(15)14-17/h3-4,7-8,11-12,14H,2,5-6,9-10,13H2,1H3 |
| InChIKey | IIRYCPJHFVZVMO-UHFFFAOYSA-N |
| Molecular Weight | 314.381 g/mol |
| SMILES | CCCOC(CCCCC(=O)OC1=CC=C2C(=C1)C=CC=C2)=O |