| SpectraBase Compound ID | BJb0jMwj0z5 |
|---|---|
| InChI | InChI=1S/C19H32O2/c1-15(2)8-5-10-17(21)11-7-13-19(4)12-6-9-16(3)18(19)14-20/h8-9,18,20H,5-7,10-14H2,1-4H3/t18-,19?/m0/s1 |
| InChIKey | DALWQIAPXAPONB-OYKVQYDMSA-N |
| Mol Weight | 292.5 g/mol |
| Molecular Formula | C19H32O2 |
| Exact Mass | 292.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | gZOO5r6FDP |
|---|---|
| Name | 2.beta.-(Hydroxymethyl)-1,3-dimethyl-1-(4-oxo-8-methyl-7-nonenyl)-3-cyclohexene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.240230268 u |
| Formula | C19H32O2 |
| InChI | InChI=1S/C19H32O2/c1-15(2)8-5-10-17(21)11-7-13-19(4)12-6-9-16(3)18(19)14-20/h8-9,18,20H,5-7,10-14H2,1-4H3/t18-,19?/m0/s1 |
| InChIKey | DALWQIAPXAPONB-OYKVQYDMSA-N |
| SMILES | C=1([C@@](C(CCCC(=O)CCC=C(C)C)(C)CCC1)(CO)[H])C |