| SpectraBase Compound ID | 2wPiBS1JRIB |
|---|---|
| InChI | InChI=1S/C20H24FO2.3C4H9.Sn/c1-3-20(23)11-9-16-14-4-5-15-12(6-7-17(22)18(15)21)13(14)8-10-19(16,20)2;3*1-3-4-2;/h1,3,6-7,13-14,16,22-23H,4-5,8-11H2,2H3;3*1,3-4H2,2H3;/t13?,14?,16?,19-,20-;;;;/m0..../s1 |
| InChIKey | WLNCHFAZVOPECV-LDRUKTAWSA-N |
| Mol Weight | 605.5 g/mol |
| Molecular Formula | C32H51FO2Sn |
| Exact Mass | 606.289511 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | rTWE7pmdPy |
|---|---|
| Name | 4-Fluoro-(17.alpha.,20E)-21-(tri-n-butylstannyl)vinylestradiol |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H51FO2Sn |
| InChI | InChI=1S/C20H24FO2.3C4H9.Sn/c1-3-20(23)11-9-16-14-4-5-15-12(6-7-17(22)18(15)21)13(14)8-10-19(16,20)2;3*1-3-4-2;/h1,3,6-7,13-14,16,22-23H,4-5,8-11H2,2H3;3*1,3-4H2,2H3;/t13?,14?,16?,19-,20-;;;;/m0..../s1 |
| InChIKey | WLNCHFAZVOPECV-LDRUKTAWSA-N |
| Molecular Weight | 605.467 g/mol |
| SMILES | Oc1ccc2c(CCC3C4[C@@]([C@@](CC4)(\C=C/[Sn](CCCC)(CCCC)CCCC)O)(CCC23)C)c1F |
| SPLASH | splash10-029t-0007690000-ec017537e2b5a4fd0920 |
| Source of Spectrum | E1-36-3070-11 |
| Synonyms | 4-Fluoro-(17.alpha.,20Z)-21-(tri-n-butylstannyl)vinylestradiol |
| Wiley ID | 1574754 |