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Pregna-1,4-dien-18-al, 20-(dimethylamino)-3-oxo-, (20S)-
SpectraBase Compound ID 5x6UKihkwk6
InChI InChI=1S/C23H33NO2/c1-15(24(3)4)19-7-8-21-18-6-5-16-13-17(26)9-11-22(16,2)20(18)10-12-23(19,21)14-25/h9,11,13-15,18-21H,5-8,10,12H2,1-4H3/t15-,18+,19+,20-,21-,22-,23-/m0/s1
InChIKey OYLWPOLNGAYAOO-ZGSYXIISSA-N
Mol Weight 355.5 g/mol
Molecular Formula C23H33NO2
Exact Mass 355.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91isj3o9r0f
Name Pregna-1,4-dien-18-al, 20-(dimethylamino)-3-oxo-, (20S)-
CAS Registry Number 91147-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33NO2
InChI InChI=1S/C23H33NO2/c1-15(24(3)4)19-7-8-21-18-6-5-16-13-17(26)9-11-22(16,2)20(18)10-12-23(19,21)14-25/h9,11,13-15,18-21H,5-8,10,12H2,1-4H3/t15-,18+,19+,20-,21-,22-,23-/m0/s1
InChIKey OYLWPOLNGAYAOO-ZGSYXIISSA-N
Molecular Weight 355.522 g/mol
SMILES [C@@]12([C@]([C@@]3(CCC=4[C@@]([C@]3(CC2)[H])(C=CC(=O)C4)C)[H])(CC[C@@]1([C@@](N(C)C)(C)[H])[H])[H])C=O
SPLASH splash10-00di-9201000000-ba8398604be07819e0c7
Source of Spectrum AC-1984-75-0
Synonyms (20S)-20-(dimethylamino)-3-oxopregna-1,4-dien-18-al 3,18-Dioxo-20S-dimethylamino-1,4-pregnadiene
Wiley ID 1345397