| SpectraBase Compound ID | 1W5E90VBxTm |
|---|---|
| InChI | InChI=1S/C16H24O4/c1-14(2)8-5-9-15(3)12(14)7-6-11(13(18)20-4)16(15,19)10-17/h6,10,12,19H,5,7-9H2,1-4H3/t12?,15-,16+/m0/s1 |
| InChIKey | OYNCKVZLFIPRPL-FFPFEORLSA-N |
| Mol Weight | 280.36 g/mol |
| Molecular Formula | C16H24O4 |
| Exact Mass | 280.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DQ6oSWG2mpP |
|---|---|
| Name | Methyl 9.alpha.-hydroxy-11-al-7-drimen-12-oate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.167459249 u |
| Formula | C16H24O4 |
| InChI | InChI=1S/C16H24O4/c1-14(2)8-5-9-15(3)12(14)7-6-11(13(18)20-4)16(15,19)10-17/h6,10,12,19H,5,7-9H2,1-4H3/t12?,15-,16+/m0/s1 |
| InChIKey | OYNCKVZLFIPRPL-FFPFEORLSA-N |
| SMILES | C=1([C@@]([C@]2(CCCC(C2CC1)(C)C)C)(C=O)O)C(=O)OC |