| SpectraBase Compound ID | KQvxcQzd5EJ |
|---|---|
| InChI | InChI=1S/C19H20O4/c1-3-9-14-10-5-8-13-17(14)23-19(21)16-12-7-6-11-15(16)18(20)22-4-2/h5-8,10-13H,3-4,9H2,1-2H3 |
| InChIKey | DBKJTCJCUXGXAR-UHFFFAOYSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C19H20O4 |
| Exact Mass | 312.136159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AFQaDbwgCZe |
|---|---|
| Name | Phthalic acid, ethyl 2-propylphenyl 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/c1-3-9-14-10-5-8-13-17(14)23-19(21)16-12-7-6-11-15(16)18(20)22-4-2/h5-8,10-13H,3-4,9H2,1-2H3 |
| InChIKey | DBKJTCJCUXGXAR-UHFFFAOYSA-N |
| Molecular Weight | 312.365 g/mol |
| SMILES | C1(=CC=CC=C1C(OCC)=O)C(OC=1C(CCC)=CC=CC1)=O |