| SpectraBase Compound ID | K2w5Tc2GHNV |
|---|---|
| InChI | InChI=1S/C20H30O/c1-12(2)10-15(21)11-14(4)16-8-9-20(5)17-7-6-13(3)18(17)19(16)20/h10,14,16-19H,3,6-9,11H2,1-2,4-5H3/t14?,16-,17-,18+,19-,20+/m1/s1 |
| InChIKey | QCUYCSJANBKKLA-CIQMHLMDSA-N |
| Mol Weight | 286.46 g/mol |
| Molecular Formula | C20H30O |
| Exact Mass | 286.229666 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EBkrnYAnbxH |
|---|---|
| Name | Lobophytumin E |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O |
| InChI | InChI=1S/C20H30O/c1-12(2)10-15(21)11-14(4)16-8-9-20(5)17-7-6-13(3)18(17)19(16)20/h10,14,16-19H,3,6-9,11H2,1-2,4-5H3/t14?,16-,17-,18+,19-,20+/m1/s1 |
| InChIKey | QCUYCSJANBKKLA-CIQMHLMDSA-N |
| Instrument Name | Finnigan-MAT-95 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np2003325 |
| Molecular Weight | 286.459 g/mol |
| Optical Rotation | [a]D25 = +61.5 (c = 0.53, CHCl3) |
| Reported Formula | C20H30O |
| SMILES | [C@]12([C@]3([C@@]([C@]2(C(CC1)=C)[H])([C@](CC3)(C(CC(C=C(C)C)=O)C)[H])[H])C)[H] |
| SPLASH | splash10-0a4i-5910000000-9fa1c303e565b80470df |
| Source of Spectrum | G4-74-2093-5 |
| Wiley ID | 1849026 |