| SpectraBase Compound ID | KUleHQLTBoI |
|---|---|
| InChI | InChI=1S/C24H46O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-23-26-24(25)22-20-8-6-4-2/h20,22H,3-19,21,23H2,1-2H3/b22-20+ |
| InChIKey | RFYKKCCZKLVYTM-LSDHQDQOSA-N |
| Mol Weight | 366.6 g/mol |
| Molecular Formula | C24H46O2 |
| Exact Mass | 366.349781 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Av5X6Ce9JO9 |
|---|---|
| Name | 2-Heptenoic acid, heptadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 366.349780719 u |
| Formula | C24H46O2 |
| InChI | InChI=1S/C24H46O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-21-23-26-24(25)22-20-8-6-4-2/h20,22H,3-19,21,23H2,1-2H3/b22-20+ |
| InChIKey | RFYKKCCZKLVYTM-LSDHQDQOSA-N |
| Molecular Weight | 366.630 g/mol |
| SMILES | C(\C=C\C(OCCCCCCCCCCCCCCCCC)=O)CCC |