| SpectraBase Compound ID | IJpPykNKuOa |
|---|---|
| InChI | InChI=1S/C11H12O4/c1-2-13-11(12)6-8-3-4-9-10(5-8)15-7-14-9/h3-5H,2,6-7H2,1H3 |
| InChIKey | AAPLOOSRPPYKGO-UHFFFAOYSA-N |
| Mol Weight | 208.21 g/mol |
| Molecular Formula | C11H12O4 |
| Exact Mass | 208.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IT9VZ9yN68s |
|---|---|
| Name | Ethyl homopiperonylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.073558862 u |
| Formula | C11H12O4 |
| InChI | InChI=1S/C11H12O4/c1-2-13-11(12)6-8-3-4-9-10(5-8)15-7-14-9/h3-5H,2,6-7H2,1H3 |
| InChIKey | AAPLOOSRPPYKGO-UHFFFAOYSA-N |
| Molecular Weight | 208.213 g/mol |
| SMILES | C(=O)(OCC)CC1=CC=C2OCOC2=C1 |