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16-selena-5.alpha.-androstane
SpectraBase Compound ID 9F5v76lBIc
InChI InChI=1S/C18H30Se/c1-17-10-8-15-14(16(17)11-19-12-17)7-6-13-5-3-4-9-18(13,15)2/h13-16H,3-12H2,1-2H3/t13-,14-,15+,16+,17-,18+/m1/s1
InChIKey IQBMQZYOZXAJFX-LMMHAMTPSA-N
Mol Weight 325.41 g/mol
Molecular Formula C18H30Se
Exact Mass 326.151273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xR8yIZX3KW
Name 16-selena-5.alpha.-androstane
CAS Registry Number 125329-13-7
Comments Less than 3 mono-isotopic peaks
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Formula C18H30Se
InChI InChI=1S/C18H30Se/c1-17-10-8-15-14(16(17)11-19-12-17)7-6-13-5-3-4-9-18(13,15)2/h13-16H,3-12H2,1-2H3/t13-,14-,15+,16+,17-,18+/m1/s1
InChIKey IQBMQZYOZXAJFX-LMMHAMTPSA-N
Molecular Weight 325.410 g/mol
SMILES [C@]12([C@@]3([C@@](CCCC3)([H])CC[C@]1([C@@]1(C[Se]C[C@]1(CC2)C)[H])[H])C)[H]
SPLASH splash10-004i-0009000000-1e5ab85eeb748d004862
Source of Spectrum J-55-2176-54
Synonyms (3aS,3bR,5aR,9aS,9bS,11aS)-9a,11a-dimethylhexadecahydrophenanthro[1,2-c]selenophene
Wiley ID 1324796