| SpectraBase Compound ID | 64EMmQB65OB |
|---|---|
| InChI | InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,12-17,19-20H,2-9H2,1H3/t12-,13-,14+,15+,16-,17-,18-/m0/s1 |
| InChIKey | CMXKUJNZWYTFJN-XFUVECHXSA-N |
| Mol Weight | 276.42 g/mol |
| Molecular Formula | C18H28O2 |
| Exact Mass | 276.20893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ux5eWfkfRr |
|---|---|
| Name | Bolandiol |
| Alternate Name(s) | 3.beta.-dihydronandrolone 19-nor-4-androstenediol 3.beta.,17.beta.-dihydroxyestr-4-ene (3S,8R,9S,10R,13S,14S,17S)-13-methyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H28O2 |
| InChI | InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,12-17,19-20H,2-9H2,1H3/t12-,13-,14+,15+,16-,17-,18-/m0/s1 |
| InChIKey | CMXKUJNZWYTFJN-XFUVECHXSA-N |
| Molecular Weight | 276.420 g/mol |
| SMILES | O[C@@]1([C@]2(CC[C@@]3([C@]4(CC[C@@](C=C4CC[C@]3([C@@]2(CC1)[H])[H])(O)[H])[H])[H])C)[H] |
| SPLASH | splash10-002f-8910000000-7e8eef46cea98077473a |
| Source of Spectrum | SWG-33-2107-0 |
| Wiley ID | 1809526 |