| SpectraBase Compound ID | Jd654ou6xVd |
|---|---|
| InChI | InChI=1S/C15H20O2/c1-2-3-5-12-8-10-13(11-9-12)15(16)17-14-6-4-7-14/h8-11,14H,2-7H2,1H3 |
| InChIKey | ZTHKVMBWGQYZRK-UHFFFAOYSA-N |
| Mol Weight | 232.32 g/mol |
| Molecular Formula | C15H20O2 |
| Exact Mass | 232.14633 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 | 6AvSYuVdrRn |
|---|---|
| Name | 4-Butylbenzoic acid, cyclobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.146329882 u |
| Formula | C15H20O2 |
| InChI | InChI=1S/C15H20O2/c1-2-3-5-12-8-10-13(11-9-12)15(16)17-14-6-4-7-14/h8-11,14H,2-7H2,1H3 |
| InChIKey | ZTHKVMBWGQYZRK-UHFFFAOYSA-N |
| Molecular Weight | 232.323 g/mol |
| SMILES | C(OC1CCC1)(=O)C1=CC=C(CCCC)C=C1 |