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16.beta,-Fluoromibolerone
SpectraBase Compound ID 7ndU2DqDg7L
InChI InChI=1S/C20H29FO2/c1-11-8-12-9-13(22)4-5-14(12)15-6-7-19(2)16(18(11)15)10-17(21)20(19,3)23/h9,11,14-18,23H,4-8,10H2,1-3H3/t11-,14+,15?,16?,17+,18?,19+,20+/m1/s1
InChIKey FSVMFSKDHAYALI-NSEPXXOVSA-N
Mol Weight 320.45 g/mol
Molecular Formula C20H29FO2
Exact Mass 320.215158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZpopvT3Xl7
Name 16.beta,-Fluoromibolerone
Alternate Name(s) (7R,10R,13S,16S,17R)-16-fluoranyl-7,13,17-trimethyl-17-oxidanyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29FO2
InChI InChI=1S/C20H29FO2/c1-11-8-12-9-13(22)4-5-14(12)15-6-7-19(2)16(18(11)15)10-17(21)20(19,3)23/h9,11,14-18,23H,4-8,10H2,1-3H3/t11-,14+,15?,16?,17+,18?,19+,20+/m1/s1
InChIKey FSVMFSKDHAYALI-NSEPXXOVSA-N
Molecular Weight 320.448 g/mol
SMILES O[C@@]1([C@@]2(C(C3[C@@](CC=4[C@@](C3CC2)(CCC(=O)C4)[H])(C)[H])C[C@@]1(F)[H])C)C
SPLASH splash10-0596-9502000000-30453bc012dfe2c182be
Source of Spectrum E1-35-2126-5
Wiley ID 1574345