| SpectraBase Compound ID | 8CmUyyWTE9G |
|---|---|
| InChI | InChI=1S/C15H20O5/c1-11(2)10-20-15(17)13-6-4-5-12(9-13)14(16)19-8-7-18-3/h4-6,9,11H,7-8,10H2,1-3H3 |
| InChIKey | RPHCKIKSGYJDJM-UHFFFAOYSA-N |
| Mol Weight | 280.32 g/mol |
| Molecular Formula | C15H20O5 |
| Exact Mass | 280.131074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HPnSgxP8xtg |
|---|---|
| Name | Isophthalic acid, 2-methoxyethyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.131073739 u |
| Formula | C15H20O5 |
| InChI | InChI=1S/C15H20O5/c1-11(2)10-20-15(17)13-6-4-5-12(9-13)14(16)19-8-7-18-3/h4-6,9,11H,7-8,10H2,1-3H3 |
| InChIKey | RPHCKIKSGYJDJM-UHFFFAOYSA-N |
| SMILES | C1(=CC(=CC=C1)C(OCCOC)=O)C(OCC(C)C)=O |