| SpectraBase Compound ID | Es2Lfz3cuPA |
|---|---|
| InChI | InChI=1S/C20H32O/c1-15(2)13-20(21)14-18(5)19-11-9-16(3)7-6-8-17(4)10-12-19/h8-9,11,15,18-19H,3,6-7,10,12-14H2,1-2,4-5H3/b11-9+,17-8+/t18?,19-/m1/s1 |
| InChIKey | WCPMPLJZWAHSJJ-SILMOEHZSA-N |
| Mol Weight | 288.5 g/mol |
| Molecular Formula | C20H32O |
| Exact Mass | 288.245316 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4sLx11iHpAH |
|---|---|
| Name | Lobophytumin B |
| Appearance | Colorless oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O |
| InChI | InChI=1S/C20H32O/c1-15(2)13-20(21)14-18(5)19-11-9-16(3)7-6-8-17(4)10-12-19/h8-9,11,15,18-19H,3,6-7,10,12-14H2,1-2,4-5H3/b11-9+,17-8+/t18?,19-/m1/s1 |
| InChIKey | WCPMPLJZWAHSJJ-SILMOEHZSA-N |
| Instrument Name | Finnigan-MAT-95 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np2003325 |
| Molecular Weight | 288.475 g/mol |
| Optical Rotation | [a]D24 = +46.6 (c = 1.01, CHCl3) |
| Reported Formula | C20H32O |
| SMILES | C1\C=C\(CC[C@@](\C=C\C(C1)=C)(C(CC(CC(C)C)=O)C)[H])C |
| SPLASH | splash10-052r-2910000000-e1dc6e89f84d70dab0b7 |
| Source of Spectrum | G4-74-2093-2 |
| Wiley ID | 1849023 |