| SpectraBase Compound ID | 825QZVcRw1H |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-7-4-5-10(16)15(3)6-9-11(13(17)12(7)15)8(2)14(18)19-9/h9-13,16-17H,1-2,4-6H2,3H3/t9-,10-,11+,12+,13-,15+/m0/s1 |
| InChIKey | XUTVRCGEUDNRBV-JSXSYOHWSA-N |
| Mol Weight | 264.32 g/mol |
| Molecular Formula | C15H20O4 |
| Exact Mass | 264.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | tFSYvEmNJi |
|---|---|
| Name | Eleganolactone A |
| Appearance | oil |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-7-4-5-10(16)15(3)6-9-11(13(17)12(7)15)8(2)14(18)19-9/h9-13,16-17H,1-2,4-6H2,3H3/t9-,10-,11+,12+,13-,15+/m0/s1 |
| InChIKey | XUTVRCGEUDNRBV-JSXSYOHWSA-N |
| Instrument Name | Micromass model Autospec |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np020390y |
| Molecular Weight | 264.321 g/mol |
| SMILES | O[C@@]1([C@]2(C(CC[C@@]([C@]2(C[C@]2([C@]1(C(C(O2)=O)=C)[H])[H])C)(O)[H])=C)[H])[H] |
| SPLASH | splash10-0awa-9620000000-c9e2c5f9b6cf221020c9 |
| Source of Spectrum | G4-66-947-2 |
| Wiley ID | 1881430 |