| SpectraBase Compound ID | 5qg3TYAYPa2 |
|---|---|
| InChI | InChI=1S/C15H24O2/c1-15(2,3)17-14(16)12-6-4-5-9-13-10-7-8-11-13/h7-8,10H,4-6,9,11-12H2,1-3H3 |
| InChIKey | IPOFMXXCGAJKJD-UHFFFAOYSA-N |
| Mol Weight | 236.35 g/mol |
| Molecular Formula | C15H24O2 |
| Exact Mass | 236.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FCZxHo3CiBJ |
|---|---|
| Name | 1,3-Cyclopentadiene-1-hexanoic acid, 1,1-dimethylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.177630011 u |
| Formula | C15H24O2 |
| InChI | InChI=1S/C15H24O2/c1-15(2,3)17-14(16)12-6-4-5-9-13-10-7-8-11-13/h7-8,10H,4-6,9,11-12H2,1-3H3 |
| InChIKey | IPOFMXXCGAJKJD-UHFFFAOYSA-N |
| Molecular Weight | 236.355 g/mol |
| SMILES | C(OC(C)(C)C)(=O)CCCCCC1=CC=CC1 |