| SpectraBase Compound ID | 72QtWjYVpSF |
|---|---|
| InChI | InChI=1S/C20H26O3/c1-12(2)18-13-5-8-16-19(3,14(13)6-7-15(18)22)10-9-17(23)20(16,4)11-21/h6-7,9-10,12,16,21-22H,5,8,11H2,1-4H3/t16-,19-,20-/m1/s1 |
| InChIKey | FPNBOQARUCJXBH-NSISKUIASA-N |
| Mol Weight | 314.43 g/mol |
| Molecular Formula | C20H26O3 |
| Exact Mass | 314.188195 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4pMBA1zvLHP |
|---|---|
| Name | Trogopteroid G |
| Appearance | White powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H26O3 |
| InChI | InChI=1S/C20H26O3/c1-12(2)18-13-5-8-16-19(3,14(13)6-7-15(18)22)10-9-17(23)20(16,4)11-21/h6-7,9-10,12,16,21-22H,5,8,11H2,1-4H3/t16-,19-,20-/m1/s1 |
| InChIKey | FPNBOQARUCJXBH-NSISKUIASA-N |
| Instrument Name | Finnigan-4510 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np900814s |
| Optical Rotation | [a]D24 = +105.6 (c = 0.09, MeOH) |
| Reported Formula | C20H27O3 |
| SMILES | OC[C@]1(C(C=C[C@@]2(c3ccc(c(c3CC[C@@]12[H])C(C)C)O)C)=O)C |
| SPLASH | splash10-00os-0090000000-b2be07170baa65789931 |
| Source of Spectrum | G4-73-868-7 |
| Wiley ID | 1846447 |