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6-beta-fluoro-2-alpha-hydroxyandrost-4-ene-3,17-dione
SpectraBase Compound ID 1a0lFG6f3VG
InChI InChI=1S/C19H25FO3/c1-18-6-5-12-10(11(18)3-4-17(18)23)7-14(20)13-8-15(21)16(22)9-19(12,13)2/h8,10-12,14,16,22H,3-7,9H2,1-2H3/t10-,11-,12-,14+,16+,18-,19+/m0/s1
InChIKey TWMNAQCHWKHKJL-HRGZSNLFSA-N
Mol Weight 320.4 g/mol
Molecular Formula C19H25FO3
Exact Mass 320.178773 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EPe2UL0KRw5
Name 6-beta-fluoro-2-alpha-hydroxyandrost-4-ene-3,17-dione
Alternate Name(s) (2alpha,6beta)-6-fluoro-2-hydroxyandrost-4-ene-3,17-dione 6-.beta.-fluoro-2-.alpha.-hydroxyandrost-4-ene-3,17-dione
CAS Registry Number 89561-81-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25FO3
InChI InChI=1S/C19H25FO3/c1-18-6-5-12-10(11(18)3-4-17(18)23)7-14(20)13-8-15(21)16(22)9-19(12,13)2/h8,10-12,14,16,22H,3-7,9H2,1-2H3/t10-,11-,12-,14+,16+,18-,19+/m0/s1
InChIKey TWMNAQCHWKHKJL-HRGZSNLFSA-N
Molecular Weight 320.404 g/mol
SMILES O[C@]1(C(=O)C=C2[C@@]([C@@]3([C@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])(C[C@]2(F)[H])[H])[H])(C1)C)[H]
SPLASH splash10-004i-2293000000-1149da157d231fc4bc6f
Source of Spectrum W5-1989-35265-30271
Wiley ID 1320242