| SpectraBase Compound ID | I1xebMdOnWb |
|---|---|
| InChI | InChI=1S/C14H14O3/c1-3-4-5-6-7-12-8-10-14(16-12)11-9-13(15-2)17-14/h7-8,10,13H,9,11H2,1-2H3/b12-7+/t13?,14-/m0/s1 |
| InChIKey | BACKKBRUFWBBSR-WEWUPFQBSA-N |
| Mol Weight | 230.26 g/mol |
| Molecular Formula | C14H14O3 |
| Exact Mass | 230.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A68dXwhhIiv |
|---|---|
| Name | Flosculin B |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H14O3 |
| InChI | InChI=1S/C14H14O3/c1-3-4-5-6-7-12-8-10-14(16-12)11-9-13(15-2)17-14/h7-8,10,13H,9,11H2,1-2H3/b12-7+/t13?,14-/m0/s1 |
| InChIKey | BACKKBRUFWBBSR-WEWUPFQBSA-N |
| Molecular Weight | 230.263 g/mol |
| SMILES | [C@@]12(OC(OC)CC2)O\C(=C\C#CC#CC)C=C1 |
| SPLASH | splash10-05ir-5930000000-7439096edcd64ccee4e1 |
| Source of Spectrum | G4-69-297-2 |
| Wiley ID | 1694291 |