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(8R,9S,10R,13S,14S)-4-bromanyl-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione
SpectraBase Compound ID Ib4UtEEjNKA
InChI InChI=1S/C18H23BrO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h10-12,14H,2-9H2,1H3/t10-,11-,12-,14+,18+/m1/s1
InChIKey CYSUPIOLXYOIGM-ATYZGLLASA-N
Mol Weight 351.28 g/mol
Molecular Formula C18H23BrO2
Exact Mass 350.088143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSarKBNpuK4
Name (8R,9S,10R,13S,14S)-4-bromanyl-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione
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Formula C18H23BrO2
InChI InChI=1S/C18H23BrO2/c1-18-9-8-11-10-4-6-15(20)17(19)13(10)3-2-12(11)14(18)5-7-16(18)21/h10-12,14H,2-9H2,1H3/t10-,11-,12-,14+,18+/m1/s1
InChIKey CYSUPIOLXYOIGM-ATYZGLLASA-N
Molecular Weight 351.284 g/mol
SMILES C12=C(C(=O)CC[C@@]2([C@]2(CC[C@]3([C@]([C@@]2(CC1)[H])(CCC3=O)[H])C)[H])[H])Br
SPLASH splash10-006x-9272000000-494f69593097eecaf3c8
Source of Spectrum KC-0-1141-2
Synonyms (8R,9S,10R,13S,14S)-4-bromo-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione (8R,9S,10R,13S,14S)-4-bromo-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-quinone
Wiley ID 824643