![(3a.beta.4a.alpha.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]futan-2,5-dione](/api/spectrum/8X2OqcHjury/structure.png?h=300&w=458 "(3a.beta.4a.alpha.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]futan-2,5-dione")
| SpectraBase Compound ID | 6LBgf50AMFG |
|---|---|
| InChI | InChI=1S/C13H18O3/c1-13-4-2-3-10(14)9(13)5-8-6-12(15)16-11(8)7-13/h8-9,11H,2-7H2,1H3/t8-,9-,11-,13+/m0/s1 |
| InChIKey | PJSXWGRBQPZVIK-LKAMGYQZSA-N |
| Mol Weight | 222.28 g/mol |
| Molecular Formula | C13H18O3 |
| Exact Mass | 222.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8X2OqcHjury |
|---|---|
| Name | (3a.beta.4a.alpha.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]futan-2,5-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H18O3 |
| InChI | InChI=1S/C13H18O3/c1-13-4-2-3-10(14)9(13)5-8-6-12(15)16-11(8)7-13/h8-9,11H,2-7H2,1H3/t8-,9-,11-,13+/m0/s1 |
| InChIKey | PJSXWGRBQPZVIK-LKAMGYQZSA-N |
| Molecular Weight | 222.284 g/mol |
| SMILES | [C@@]12([C@@](C[C@@]3([C@@](OC(=O)C3)(C1)[H])[H])(C(=O)CCC2)[H])C |
| SPLASH | splash10-0f72-9320000000-7ff616d6a7ce366c05dc |
| Source of Spectrum | KC-1993-244-32 |
| Synonyms | (3a.beta.,4a.alpha.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]furan-2,5-dione (3a.beta.,5.beta.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]futan-2,5-dione (3a.beta.5.alpha.,8a.beta.,9a.beta.)-3,3a,4,4a,6,7,8,8a,9,9a-decahydro-8a-methylnaphtho[2,3-b]futan-2,5-dione (3aS,4aR,8aR,9aS)-8a-methyldecahydronaphtho[2,3-b]furan-2,5-dione |
| Wiley ID | 778870 |