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Androst-4-ene-3,17-dione, 4-methoxy-
SpectraBase Compound ID AChxnlRCRjv
InChI InChI=1S/C20H28O3/c1-19-11-9-16(21)18(23-3)15(19)5-4-12-13-6-7-17(22)20(13,2)10-8-14(12)19/h12-14H,4-11H2,1-3H3/t12-,13-,14-,19+,20-/m0/s1
InChIKey JYMVNNNTLDUEBG-PFIYWFKMSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2YRIHiyxTX
Name Androst-4-ene-3,17-dione, 4-methoxy-
CAS Registry Number 20986-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-19-11-9-16(21)18(23-3)15(19)5-4-12-13-6-7-17(22)20(13,2)10-8-14(12)19/h12-14H,4-11H2,1-3H3/t12-,13-,14-,19+,20-/m0/s1
InChIKey JYMVNNNTLDUEBG-PFIYWFKMSA-N
Molecular Weight 316.441 g/mol
SMILES [C@@]12(C(=C(OC)C(CC2)=O)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])C
SPLASH splash10-0g6r-4945000000-3adc54ba28c04f07449f
Source of Spectrum KC-1983-2683-0
Synonyms (8R,9S,10R,13S,14S)-4-methoxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione (8R,9S,10R,13S,14S)-4-methoxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-quinone 4-Methoxyandrost-4-ene-3,17-dione 4-Methoxyandrostenedione
Wiley ID 1317074