| SpectraBase Compound ID | 76FMlEqbuLO |
|---|---|
| InChI | InChI=1S/C14H16O4/c1-2-17-13(15)11-8-3-4-9-12(11)14(16)18-10-6-5-7-10/h3-4,8-10H,2,5-7H2,1H3 |
| InChIKey | AHZOVQYJMCTOHT-UHFFFAOYSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C14H16O4 |
| Exact Mass | 248.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JgR4z1LqoBS |
|---|---|
| Name | Phthalic acid, cyclobutyl ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.104858991 u |
| Formula | C14H16O4 |
| InChI | InChI=1S/C14H16O4/c1-2-17-13(15)11-8-3-4-9-12(11)14(16)18-10-6-5-7-10/h3-4,8-10H,2,5-7H2,1H3 |
| InChIKey | AHZOVQYJMCTOHT-UHFFFAOYSA-N |
| Molecular Weight | 248.278 g/mol |
| SMILES | C1(=C(C=CC=C1)C(OCC)=O)C(OC1CCC1)=O |