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(5-alpha)-1-methylandrostane-1-ene-3,17-dione
SpectraBase Compound ID EHgcLCJtPfG
InChI InChI=1S/C20H28O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h10,13,15-17H,4-9,11H2,1-3H3/t13-,15-,16-,17-,19-,20-/m0/s1
InChIKey STLDQAJEGPFPIE-SWEGMTMGSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2abZLVNGeu
Name (5-alpha)-1-methylandrostane-1-ene-3,17-dione
Alternate Name(s) (5S,8R,9S,10S,13S,14S)-1,10,13-trimethyl-5,6,7,8,9,10,11,12,13,14,15,16-dodecahydro-3H-cyclopenta[a]phenanthrene-3,17(4H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-12-10-14(21)11-13-4-5-15-16-6-7-18(22)19(16,2)9-8-17(15)20(12,13)3/h10,13,15-17H,4-9,11H2,1-3H3/t13-,15-,16-,17-,19-,20-/m0/s1
InChIKey STLDQAJEGPFPIE-SWEGMTMGSA-N
Literature Reference DOI 10.1002/cbdv.200590019
Molecular Weight 300.442 g/mol
SMILES C=1C(C[C@]2([C@](C1C)([C@@]1([C@@](CC2)([C@]2([C@](CC1)(C(CC2)=O)C)[H])[H])[H])C)[H])=O
SPLASH splash10-0pi0-4900000000-cb281e64bd4ea280d887
Source of Spectrum CBD-2-399-4
Wiley ID 1792474