| SpectraBase Compound ID | 4sAFwyRZgEc |
|---|---|
| InChI | InChI=1S/C14H20O2/c1-4-11-8-7-9-13(10-11)16-14(15)12(5-2)6-3/h7-10,12H,4-6H2,1-3H3 |
| InChIKey | NBFPIGWZMJMYIK-UHFFFAOYSA-N |
| Mol Weight | 220.31 g/mol |
| Molecular Formula | C14H20O2 |
| Exact Mass | 220.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9QuJq8nLT5K |
|---|---|
| Name | 2-Ethylbutyric acid, 3-ethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.146329882 u |
| Formula | C14H20O2 |
| InChI | InChI=1S/C14H20O2/c1-4-11-8-7-9-13(10-11)16-14(15)12(5-2)6-3/h7-10,12H,4-6H2,1-3H3 |
| InChIKey | NBFPIGWZMJMYIK-UHFFFAOYSA-N |
| Molecular Weight | 220.312 g/mol |
| SMILES | CCC1=CC(OC(=O)C(CC)CC)=CC=C1 |