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2-Fluoro-(17.alpha.,20E)-21-(tri-n-butylstannyl)vinylestradiol
SpectraBase Compound ID CyUmFmUK7Ds
InChI InChI=1S/C20H24FO2.3C4H9.Sn/c1-3-20(23)9-7-16-14-5-4-12-10-18(22)17(21)11-15(12)13(14)6-8-19(16,20)2;3*1-3-4-2;/h1,3,10-11,13-14,16,22-23H,4-9H2,2H3;3*1,3-4H2,2H3;/t13?,14?,16?,19-,20-;;;;/m0..../s1
InChIKey QYYYOWCZHIMJFW-LDRUKTAWSA-N
Mol Weight 605.5 g/mol
Molecular Formula C32H51FO2Sn
Exact Mass 606.289511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAnKChyqXSe
Name 2-Fluoro-(17.alpha.,20E)-21-(tri-n-butylstannyl)vinylestradiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H51FO2Sn
InChI InChI=1S/C20H24FO2.3C4H9.Sn/c1-3-20(23)9-7-16-14-5-4-12-10-18(22)17(21)11-15(12)13(14)6-8-19(16,20)2;3*1-3-4-2;/h1,3,10-11,13-14,16,22-23H,4-9H2,2H3;3*1,3-4H2,2H3;/t13?,14?,16?,19-,20-;;;;/m0..../s1
InChIKey QYYYOWCZHIMJFW-LDRUKTAWSA-N
Molecular Weight 605.467 g/mol
SMILES Oc1c(cc2c(CCC3C4[C@@]([C@@](CC4)(\C=C/[Sn](CCCC)(CCCC)CCCC)O)(CCC23)C)c1)F
SPLASH splash10-016r-0008290000-fd35c684677264586339
Source of Spectrum E1-36-3069-7
Synonyms 2-Fluoro-(17.alpha.,20Z)-21-(tri-n-butylstannyl)vinylestradiol
Wiley ID 1574756