| SpectraBase Compound ID | KpywIVtGjCC |
|---|---|
| InChI | InChI=1S/C22H42O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22(23)24-20-6-4-2/h4H,2-3,5-21H2,1H3 |
| InChIKey | IZKMGIHXJFVCKF-UHFFFAOYSA-N |
| Mol Weight | 354.6 g/mol |
| Molecular Formula | C22H42O3 |
| Exact Mass | 354.313395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LqYlNYzRfG4 |
|---|---|
| Name | Carbonic acid, but-3-en-1-yl heptadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.313395209 u |
| Formula | C22H42O3 |
| InChI | InChI=1S/C22H42O3/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-22(23)24-20-6-4-2/h4H,2-3,5-21H2,1H3 |
| InChIKey | IZKMGIHXJFVCKF-UHFFFAOYSA-N |
| Molecular Weight | 354.575 g/mol |
| SMILES | C(OCCCCCCCCCCCCCCCCC)(=O)OCCC=C |