| SpectraBase Compound ID | 8sRPNsfLz4a |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-7-6-10-12(8(2)14(18)19-10)13(17)15(3)9(7)4-5-11(15)16/h4-5,7-10,12-13,17H,6H2,1-3H3/t7-,8-,9-,10+,12-,13-,15+/m1/s1 |
| InChIKey | ICKWITMQEROMDG-QNYKULNCSA-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 | 1ufZX4nQum |
|---|---|
| Name | Desacetyl-1-epi-isotenulin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-7-6-10-12(8(2)14(18)19-10)13(17)15(3)9(7)4-5-11(15)16/h4-5,7-10,12-13,17H,6H2,1-3H3/t7-,8-,9-,10+,12-,13-,15+/m1/s1 |
| InChIKey | ICKWITMQEROMDG-QNYKULNCSA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | O[C@]1([C@]2([C@](C=CC2=O)([C@@](C[C@]2([C@]1([C@](C(=O)O2)(C)[H])[H])[H])(C)[H])[H])C)[H] |
| SPLASH | splash10-00di-0900000000-fbf124a57a1746b7ae2c |
| Source of Spectrum | X2-47-535-1 |
| Synonyms | 4,12-Dioxo-6-hydroxy-13,14,15-trimethyl-13-oxatricyclo[8.3.3.0.0]tridec-2-ene (1R,3aS,5R,5aS,8aR,9R,9aS)-9-hydroxy-1,5,8a-trimethyl-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,7-b]furan-2,8-dione (1R,3aS,5R,5aS,8aR,9R,9aS)-1,5,8a-trimethyl-9-oxidanyl-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,7-b]furan-2,8-dione |
| Wiley ID | 1601438 |