| SpectraBase Compound ID | Ate54CUSFz2 |
|---|---|
| InChI | InChI=1S/C26H52O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-28-26(27)24-22-20-10-8-6-4-2/h3-25H2,1-2H3 |
| InChIKey | XLZWKSKTFFCNRA-UHFFFAOYSA-N |
| Mol Weight | 396.7 g/mol |
| Molecular Formula | C26H52O2 |
| Exact Mass | 396.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IhAw8toa76U |
|---|---|
| Name | Nonanoic acid, heptadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.396730912 u |
| Formula | C26H52O2 |
| InChI | InChI=1S/C26H52O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-28-26(27)24-22-20-10-8-6-4-2/h3-25H2,1-2H3 |
| InChIKey | XLZWKSKTFFCNRA-UHFFFAOYSA-N |
| Molecular Weight | 396.700 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCOC(CCCCCCCC)=O |