| SpectraBase Compound ID | EyZeEnJNtAf |
|---|---|
| InChI | InChI=1S/C18H17ClO5/c1-2-22-17(20)13-7-3-4-8-14(13)18(21)24-12-11-23-16-10-6-5-9-15(16)19/h3-10H,2,11-12H2,1H3 |
| InChIKey | JNZMOAUMCLVTTI-UHFFFAOYSA-N |
| Mol Weight | 348.78 g/mol |
| Molecular Formula | C18H17ClO5 |
| Exact Mass | 348.076451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8JmeMdZ2l1R |
|---|---|
| Name | Phthalic acid, 2-(4-chlorophenoxy)ethyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.076451342 u |
| Formula | C18H17ClO5 |
| InChI | InChI=1S/C18H17ClO5/c1-2-22-17(20)13-7-3-4-8-14(13)18(21)24-12-11-23-16-10-6-5-9-15(16)19/h3-10H,2,11-12H2,1H3 |
| InChIKey | JNZMOAUMCLVTTI-UHFFFAOYSA-N |
| Molecular Weight | 348.782 g/mol |
| SMILES | C(C1=CC=CC=C1C(OCCOC1=CC=CC=C1Cl)=O)(OCC)=O |