![(3S,3aS,5aS,7R,9bS)-3,5a,9-trimethyl-7-oxidanyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione](/api/spectrum/3DaVyxxEjMH/structure.png?h=300&w=458 "(3S,3aS,5aS,7R,9bS)-3,5a,9-trimethyl-7-oxidanyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione")
| SpectraBase Compound ID | Cx8xoIbItZI |
|---|---|
| InChI | InChI=1S/C15H20O4/c1-7-9-4-5-15(3)6-10(16)12(17)8(2)11(15)13(9)19-14(7)18/h7,9-10,13,16H,4-6H2,1-3H3/t7-,9-,10+,13-,15-/m0/s1 |
| InChIKey | SRDOFTZSVIZJJW-XIPLXQJESA-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 | 3DaVyxxEjMH |
|---|---|
| Name | (3S,3aS,5aS,7R,9bS)-3,5a,9-trimethyl-7-oxidanyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O4 |
| InChI | InChI=1S/C15H20O4/c1-7-9-4-5-15(3)6-10(16)12(17)8(2)11(15)13(9)19-14(7)18/h7,9-10,13,16H,4-6H2,1-3H3/t7-,9-,10+,13-,15-/m0/s1 |
| InChIKey | SRDOFTZSVIZJJW-XIPLXQJESA-N |
| Molecular Weight | 264.321 g/mol |
| SMILES | O[C@@]1(C[C@]2(C(=C(C1=O)C)[C@]1(OC(=O)[C@]([C@@]1(CC2)[H])(C)[H])[H])C)[H] |
| SPLASH | splash10-03di-0090000000-2f1b71d73c1197a1f216 |
| Source of Spectrum | K1-2000-2148-8 |
| Synonyms | (3S,3aS,5aS,7R,9bS)-7-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g]benzofuran-2,8-dione (3S,3aS,5aS,7R,9bS)-7-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g]benzofuran-2,8-quinone (3S,3aS,5aS,7R,9bS)-7-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,9b-hexahydro-3H-benzo[g][1]benzofuran-2,8-dione |
| Wiley ID | 750374 |