| SpectraBase Compound ID | 3XspwGwRm85 |
|---|---|
| InChI | InChI=1S/C18H26O5/c1-4-21-12-13-23-18(20)16-10-6-5-9-15(16)17(19)22-11-7-8-14(2)3/h5-6,9-10,14H,4,7-8,11-13H2,1-3H3 |
| InChIKey | HOKPPAPIGYZPHM-UHFFFAOYSA-N |
| Mol Weight | 322.4 g/mol |
| Molecular Formula | C18H26O5 |
| Exact Mass | 322.178024 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 | EgIDrH5FAD4 |
|---|---|
| Name | Phthalic acid, 2-ethoxyethyl isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 322.178023932 u |
| Formula | C18H26O5 |
| InChI | InChI=1S/C18H26O5/c1-4-21-12-13-23-18(20)16-10-6-5-9-15(16)17(19)22-11-7-8-14(2)3/h5-6,9-10,14H,4,7-8,11-13H2,1-3H3 |
| InChIKey | HOKPPAPIGYZPHM-UHFFFAOYSA-N |
| Molecular Weight | 322.401 g/mol |
| SMILES | C1(=C(C=CC=C1)C(=O)OCCOCC)C(OCCCC(C)C)=O |