| SpectraBase Compound ID | F4FDlBa3k6p |
|---|---|
| InChI | InChI=1S/C20H30O3/c1-18(12-21)7-3-8-19(2)15(18)6-9-20-10-13(4-5-16(19)20)14(11-20)17(22)23/h12-16H,3-11H2,1-2H3,(H,22,23)/t13-,14-,15+,16-,18?,19+,20-/m1/s1 |
| InChIKey | KVKFKHMIIMGSRS-CYERNSOMSA-N |
| Mol Weight | 318.46 g/mol |
| Molecular Formula | C20H30O3 |
| Exact Mass | 318.219495 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | C8NuWIdT12i |
|---|---|
| Name | 16.alpha.-Kauran-19-al-17-oic Acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O3 |
| InChI | InChI=1S/C20H30O3/c1-18(12-21)7-3-8-19(2)15(18)6-9-20-10-13(4-5-16(19)20)14(11-20)17(22)23/h12-16H,3-11H2,1-2H3,(H,22,23)/t13-,14-,15+,16-,18?,19+,20-/m1/s1 |
| InChIKey | KVKFKHMIIMGSRS-CYERNSOMSA-N |
| Molecular Weight | 318.457 g/mol |
| SMILES | OC([C@@]1(C[C@]23[C@@]([C@]4(CCCC([C@@]4(CC3)[H])(C=O)C)C)(CC[C@@]1(C2)[H])[H])[H])=O |
| SPLASH | splash10-000i-0094000000-b8e82c36b5d86a67efc4 |
| Source of Spectrum | X2-48-489-1 |
| Wiley ID | 1601683 |