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Androstane-3,11,17-trione, cyclic 3-(1,2-ethanediyl acetal), (5.alpha.)-
SpectraBase Compound ID 3cbTBc8Nn6b
InChI InChI=1S/C21H30O4/c1-19-7-8-21(24-9-10-25-21)11-13(19)3-4-14-15-5-6-17(23)20(15,2)12-16(22)18(14)19/h13-15,18H,3-12H2,1-2H3/t13-,14-,15-,18+,19-,20-/m0/s1
InChIKey NIIOEGKZKQFQOJ-FLVPGIQOSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4l8t832K522
Name Androstane-3,11,17-trione, cyclic 3-(1,2-ethanediyl acetal), (5.alpha.)-
Alternate Name(s) Spiro[3H-cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane], androstane-3,11,17-trione deriv. (1'S,2'S,7'S,10'S,11'S,15'S)-2',15'-dimethylspiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane]-14',17'-dione 3,3-Ethylenedioxy-5.alpha.-androstane-11,17-dione
CAS Registry Number 113278-74-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-19-7-8-21(24-9-10-25-21)11-13(19)3-4-14-15-5-6-17(23)20(15,2)12-16(22)18(14)19/h13-15,18H,3-12H2,1-2H3/t13-,14-,15-,18+,19-,20-/m0/s1
InChIKey NIIOEGKZKQFQOJ-FLVPGIQOSA-N
Molecular Weight 346.467 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(C(C2)=O)[H])(CCC2(OCCO2)C4)C)[H])[H])(CCC1=O)[H])C
SPLASH splash10-0002-9201000000-f3d18d9214b0ea91e073
Source of Spectrum KC-1988-1656-5
Wiley ID 1339504