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(8S,9S,10S,13S,14S)-10-chloranyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
SpectraBase Compound ID IlunwKtYcJe
InChI InChI=1S/C18H21ClO2/c1-17-8-7-15-13(14(17)4-5-16(17)21)3-2-11-10-12(20)6-9-18(11,15)19/h6,9-10,13-15H,2-5,7-8H2,1H3/t13-,14-,15-,17-,18+/m0/s1
InChIKey DMUVDGYKPICJEM-FTAMUGHTSA-N
Mol Weight 304.82 g/mol
Molecular Formula C18H21ClO2
Exact Mass 304.123008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2swCJk1A9o
Name (8S,9S,10S,13S,14S)-10-chloranyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione
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Formula C18H21ClO2
InChI InChI=1S/C18H21ClO2/c1-17-8-7-15-13(14(17)4-5-16(17)21)3-2-11-10-12(20)6-9-18(11,15)19/h6,9-10,13-15H,2-5,7-8H2,1H3/t13-,14-,15-,17-,18+/m0/s1
InChIKey DMUVDGYKPICJEM-FTAMUGHTSA-N
Molecular Weight 304.817 g/mol
SMILES [C@@]12(C(=CC(C=C2)=O)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])Cl
SPLASH splash10-006x-0791000000-71281960fa00cd10e9f2
Source of Spectrum AC-1994-289-13
Synonyms (8S,9S,10S,13S,14S)-10-chloro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-dione (8S,9S,10S,13S,14S)-10-chloro-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-quinone
Wiley ID 811696