| SpectraBase Compound ID | Cocatlqr0R3 |
|---|---|
| InChI | InChI=1S/C15H22O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h8-9,12-15H,2,4-7H2,1,3H3 |
| InChIKey | PNMKKWGBHSAPLG-UHFFFAOYSA-N |
| Mol Weight | 218.34 g/mol |
| Molecular Formula | C15H22O |
| Exact Mass | 218.167065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2AwRffQUcPc |
|---|---|
| Name | .Gamma.-cadinen-15-al |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.167065327 u |
| Formula | C15H22O |
| InChI | InChI=1S/C15H22O/c1-10-4-6-13-11(2)5-7-14(12(3)9-16)15(13)8-10/h8-9,12-15H,2,4-7H2,1,3H3 |
| InChIKey | PNMKKWGBHSAPLG-UHFFFAOYSA-N |
| Molecular Weight | 218.340 g/mol |
| SMILES | C12C(C(=C)CCC2C(C=O)C)CCC(=C1)C |