| SpectraBase Compound ID | E47wlEmIOwF |
|---|---|
| InChI | InChI=1S/C22H30O6/c1-13-6-9-20(25-16(4)23)22(5)11-10-18(27-28-22)14(2)7-8-17-15(3)21(24)26-19(17)12-13/h7,12,17-20H,3,6,8-11H2,1-2,4-5H3/b13-12+,14-7-/t17-,18-,19-,20-,22+/m0/s1 |
| InChIKey | DCNHEHMOEMETOF-SNTVFBAHSA-N |
| Mol Weight | 390.48 g/mol |
| Molecular Formula | C22H30O6 |
| Exact Mass | 390.204239 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LJ0oGounHdw |
|---|---|
| Name | Denticulatolide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30O6 |
| InChI | InChI=1S/C22H30O6/c1-13-6-9-20(25-16(4)23)22(5)11-10-18(27-28-22)14(2)7-8-17-15(3)21(24)26-19(17)12-13/h7,12,17-20H,3,6,8-11H2,1-2,4-5H3/b13-12+,14-7-/t17-,18-,19-,20-,22+/m0/s1 |
| InChIKey | DCNHEHMOEMETOF-SNTVFBAHSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 390.476 g/mol |
| SMILES | [C@]12(OO[C@](CC2)([C@@](OC(=O)C)(CC\C(=C\[C@@]2(OC(=O)C([C@@]2(C\C=C/1C)[H])=C)[H])C)[H])C)[H] |
| SPLASH | splash10-0006-9710000000-c89abfef4251a5eda4ad |
| Source of Spectrum | SRH-2022-10656-0 |
| Wiley ID | 1832268 |