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10.beta.-Fluoro-3-oxo-1,4-estradien-16.alpha.,17.beta.-diol
SpectraBase Compound ID 646UYHV2w5s
InChI InChI=1S/C18H23FO3/c1-17-6-5-13-12(14(17)9-15(21)16(17)22)3-2-10-8-11(20)4-7-18(10,13)19/h4,7-8,12-16,21-22H,2-3,5-6,9H2,1H3/t12-,13+,14+,15-,16+,17+,18-/m1/s1
InChIKey KQUDFRNCNNOUEA-QTTZJVNNSA-N
Mol Weight 306.38 g/mol
Molecular Formula C18H23FO3
Exact Mass 306.163123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCvJYJFywlB
Name 10.beta.-Fluoro-3-oxo-1,4-estradien-16.alpha.,17.beta.-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23FO3
InChI InChI=1S/C18H23FO3/c1-17-6-5-13-12(14(17)9-15(21)16(17)22)3-2-10-8-11(20)4-7-18(10,13)19/h4,7-8,12-16,21-22H,2-3,5-6,9H2,1H3/t12-,13+,14+,15-,16+,17+,18-/m1/s1
InChIKey KQUDFRNCNNOUEA-QTTZJVNNSA-N
Molecular Weight 306.377 g/mol
SMILES O[C@@]1(C[C@]2([C@@]3(CCC=4[C@@]([C@]3(CC[C@@]2([C@]1(O)[H])C)[H])(C=CC(C4)=O)F)[H])[H])[H]
SPLASH splash10-004j-1920000000-6e6fa28767fb849697e0
Source of Spectrum HE-1999-1377-3
Synonyms (16alpha,17beta)-10-fluoro-16,17-dihydroxyestra-1,4-dien-3-one
Wiley ID 1613591