| SpectraBase Compound ID | 8davOB6KDPg |
|---|---|
| InChI | InChI=1S/C14H18O3/c1-4-11(5-2)14(16)17-13-9-7-6-8-12(13)10(3)15/h6-9,11H,4-5H2,1-3H3 |
| InChIKey | ZJMPGKXUVXBPII-UHFFFAOYSA-N |
| Mol Weight | 234.29 g/mol |
| Molecular Formula | C14H18O3 |
| Exact Mass | 234.125594 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbeNg8pjJLG |
|---|---|
| Name | 2-Ethylbutyric acid, 2-acethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.125594437 u |
| Formula | C14H18O3 |
| InChI | InChI=1S/C14H18O3/c1-4-11(5-2)14(16)17-13-9-7-6-8-12(13)10(3)15/h6-9,11H,4-5H2,1-3H3 |
| InChIKey | ZJMPGKXUVXBPII-UHFFFAOYSA-N |
| Molecular Weight | 234.295 g/mol |
| SMILES | CC(C1=CC=CC=C1OC(=O)C(CC)CC)=O |