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16.alpha.-Fluoro-7.alpha.-methyl-3-[[(trifluoromethyl)sulfonyl]oxy]-3,5(6)-estradien-17-one
SpectraBase Compound ID AV39bpiCoHW
InChI InChI=1S/C20H24F4O4S/c1-10-7-11-8-12(28-29(26,27)20(22,23)24)3-4-13(11)14-5-6-19(2)15(17(10)14)9-16(21)18(19)25/h7-8,10,13-17H,3-6,9H2,1-2H3/t10-,13+,14-,15+,16-,17-,19+/m1/s1
InChIKey YKGYCHJJUMYDKK-CKDDSQOYSA-N
Mol Weight 436.46 g/mol
Molecular Formula C20H24F4O4S
Exact Mass 436.133143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ENPeh5sbHb
Name 16.alpha.-Fluoro-7.alpha.-methyl-3-[[(trifluoromethyl)sulfonyl]oxy]-3,5(6)-estradien-17-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24F4O4S
InChI InChI=1S/C20H24F4O4S/c1-10-7-11-8-12(28-29(26,27)20(22,23)24)3-4-13(11)14-5-6-19(2)15(17(10)14)9-16(21)18(19)25/h7-8,10,13-17H,3-6,9H2,1-2H3/t10-,13+,14-,15+,16-,17-,19+/m1/s1
InChIKey YKGYCHJJUMYDKK-CKDDSQOYSA-N
Molecular Weight 436.462 g/mol
SMILES C(S(OC1=CC2=C[C@@](C)([C@]3([C@@]4(C[C@@](F)(C([C@]4(CC[C@@]3([C@]2(CC1)[H])[H])C)=O)[H])[H])[H])[H])(=O)=O)(F)(F)F
SPLASH splash10-0ktf-7912300000-c17ffe18b014a9807b6f
Source of Spectrum E1-35-2126-41
Synonyms (7alpha,16alpha)-16-fluoro-7-methyl-17-oxoestra-3,5-dien-3-yl trifluoromethanesulfonate
Wiley ID 1574341