| SpectraBase Compound ID | bYGk8wj9YK |
|---|---|
| InChI | InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h12-14,18H,5-11H2,1-4H3 |
| InChIKey | MDWQSNIQXHNTCK-UHFFFAOYSA-N |
| Mol Weight | 286.46 g/mol |
| Molecular Formula | C20H30O |
| Exact Mass | 286.229666 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 47mtj9jEW4P |
|---|---|
| Name | (1R,4as,10Ar)-7-isopropyl-1,4A-dimethyl-1,2,3,4,4A,5,6,9,10,10A-decahydrophenanthrene-1-carbaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.229665585 u |
| Formula | C20H30O |
| InChI | InChI=1S/C20H30O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h12-14,18H,5-11H2,1-4H3 |
| InChIKey | MDWQSNIQXHNTCK-UHFFFAOYSA-N |
| SMILES | C1C2=C(C=C(C1)C(C)C)CCC1C2(CCCC1(C=O)C)C |