![(5S,7S,8S)-7,8-Diacetoxy-2-phenylbicyclo[3.3.0]oct-1-en-3-one](/api/spectrum/3QslwY8ZlIL/structure.png?h=300&w=458 "(5S,7S,8S)-7,8-Diacetoxy-2-phenylbicyclo[3.3.0]oct-1-en-3-one")
| SpectraBase Compound ID | 9wM8kl9oMeW |
|---|---|
| InChI | InChI=1S/C18H18O5/c1-10(19)22-15-9-13-8-14(21)16(12-6-4-3-5-7-12)17(13)18(15)23-11(2)20/h3-7,13,15,18H,8-9H2,1-2H3/t13-,15+,18-/m1/s1 |
| InChIKey | WXLXULIFDDTIIO-QIIPPGSGSA-N |
| Mol Weight | 314.34 g/mol |
| Molecular Formula | C18H18O5 |
| Exact Mass | 314.115424 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3QslwY8ZlIL |
|---|---|
| Name | (5S,7S,8S)-7,8-Diacetoxy-2-phenylbicyclo[3.3.0]oct-1-en-3-one |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H18O5 |
| InChI | InChI=1S/C18H18O5/c1-10(19)22-15-9-13-8-14(21)16(12-6-4-3-5-7-12)17(13)18(15)23-11(2)20/h3-7,13,15,18H,8-9H2,1-2H3/t13-,15+,18-/m1/s1 |
| InChIKey | WXLXULIFDDTIIO-QIIPPGSGSA-N |
| Molecular Weight | 314.337 g/mol |
| SMILES | C=12[C@@]([C@@](OC(=O)C)(C[C@]2(CC(C1c1ccccc1)=O)[H])[H])(OC(=O)C)[H] |
| SPLASH | splash10-0il6-0790000000-0faf623927966ae98a11 |
| Source of Spectrum | KC-0-2912-11 |
| Synonyms | (1S,2S,3aS)-1-(acetyloxy)-5-oxo-6-phenyl-1,2,3,3a,4,5-hexahydro-2-pentalenyl acetate (5S,7S,8S)-and (5R,7S,8S)-7,8-Diacetoxy-2-phenylbicyclo[3.3.0]oct-1-en-3-one Acetic acid [(1S,2S,3aS)-1-acetyloxy-5-oxo-6-phenyl-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ester [(1S,2S,3aS)-1-acetyloxy-5-oxo-6-phenyl-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] acetate [(1S,2S,3aS)-1-acetoxy-5-oxo-6-phenyl-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] acetate [(1S,2S,3aS)-1-acetyloxy-5-oxidanylidene-6-phenyl-2,3,3a,4-tetrahydro-1H-pentalen-2-yl] ethanoate |
| Wiley ID | 826375 |