| SpectraBase Compound ID | KfBgavKHKv8 |
|---|---|
| InChI | InChI=1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(23)24-21/h17,20-21H,2-16,18-19H2,1H3 |
| InChIKey | NSZKHBCGGRXTEX-UHFFFAOYSA-N |
| Mol Weight | 336.6 g/mol |
| Molecular Formula | C22H40O2 |
| Exact Mass | 336.302831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B9dvdRW3DQO |
|---|---|
| Name | 6-Heptadecyl-5,6-dihydro-2H-pyran-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.302830526 u |
| Formula | C22H40O2 |
| InChI | InChI=1S/C22H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(23)24-21/h17,20-21H,2-16,18-19H2,1H3 |
| InChIKey | NSZKHBCGGRXTEX-UHFFFAOYSA-N |
| Molecular Weight | 336.560 g/mol |
| SMILES | C1(C=CCC(O1)CCCCCCCCCCCCCCCCC)=O |