| SpectraBase Compound ID | Cc8rEZPCwJL |
|---|---|
| InChI | InChI=1S/C19H20O4/c1-2-3-6-14-22-18(20)12-13-19(21)23-17-11-7-9-15-8-4-5-10-16(15)17/h4-5,7-13H,2-3,6,14H2,1H3/b13-12+ |
| InChIKey | HSOBRBOZVSSTPO-OUKQBFOZSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C19H20O4 |
| Exact Mass | 312.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1PmLa0cmP0N |
|---|---|
| Name | Fumaric acid, 1-naphthyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.136159120 u |
| Formula | C19H20O4 |
| InChI | InChI=1S/C19H20O4/c1-2-3-6-14-22-18(20)12-13-19(21)23-17-11-7-9-15-8-4-5-10-16(15)17/h4-5,7-13H,2-3,6,14H2,1H3/b13-12+ |
| InChIKey | HSOBRBOZVSSTPO-OUKQBFOZSA-N |
| Molecular Weight | 312.365 g/mol |
| SMILES | CCCCCOC(\C=C\C(OC=1C2=CC=CC=C2C=CC1)=O)=O |