| SpectraBase Compound ID | IpDksD05a4L |
|---|---|
| InChI | InChI=1S/C23H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-25-23(24)20-19-22-17-14-15-18-22/h22H,2-21H2,1H3 |
| InChIKey | NGRWBWMGWJUELO-UHFFFAOYSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C23H44O2 |
| Exact Mass | 352.334131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GgZ55h1Q7eU |
|---|---|
| Name | 3-Cyclopentylpropionic acid, pentadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.334130655 u |
| Formula | C23H44O2 |
| InChI | InChI=1S/C23H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-25-23(24)20-19-22-17-14-15-18-22/h22H,2-21H2,1H3 |
| InChIKey | NGRWBWMGWJUELO-UHFFFAOYSA-N |
| Molecular Weight | 352.603 g/mol |
| SMILES | C(=O)(OCCCCCCCCCCCCCCC)CCC1CCCC1 |