| SpectraBase Compound ID | JYVIYB1QaVe |
|---|---|
| InChI | InChI=1S/C18H20O4/c1-2-21-17(19)9-5-6-10-18(20)22-16-12-11-14-7-3-4-8-15(14)13-16/h3-4,7-8,11-13H,2,5-6,9-10H2,1H3 |
| InChIKey | JRCPVTLKEBCUPG-UHFFFAOYSA-N |
| Mol Weight | 300.35 g/mol |
| Molecular Formula | C18H20O4 |
| Exact Mass | 300.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JmLysQovHiG |
|---|---|
| Name | Adipic acid, ethyl 2-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.136159120 u |
| Formula | C18H20O4 |
| InChI | InChI=1S/C18H20O4/c1-2-21-17(19)9-5-6-10-18(20)22-16-12-11-14-7-3-4-8-15(14)13-16/h3-4,7-8,11-13H,2,5-6,9-10H2,1H3 |
| InChIKey | JRCPVTLKEBCUPG-UHFFFAOYSA-N |
| Molecular Weight | 300.354 g/mol |
| SMILES | C(CC(=O)OC1=CC=C2C(C=CC=C2)=C1)CCC(OCC)=O |