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Pregna-1,4-dien-3-one, 20-(dimethylamino)-, (20S)-
SpectraBase Compound ID IQUbu49qxKG
InChI InChI=1S/C23H35NO/c1-15(24(4)5)19-8-9-20-18-7-6-16-14-17(25)10-12-22(16,2)21(18)11-13-23(19,20)3/h10,12,14-15,18-21H,6-9,11,13H2,1-5H3/t15-,18-,19+,20-,21-,22-,23+/m0/s1
InChIKey SGBLZTLTOQYIDO-CZWIXHKBSA-N
Mol Weight 341.5 g/mol
Molecular Formula C23H35NO
Exact Mass 341.271865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZ84hLWgXI7
Name Pregna-1,4-dien-3-one, 20-(dimethylamino)-, (20S)-
Alternate Name(s) (20S)-20-(dimethylamino)pregna-1,4-dien-3-one 3-Oxo-20S-dimethylamino-1,4-pregnadiene
CAS Registry Number 91147-27-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO
InChI InChI=1S/C23H35NO/c1-15(24(4)5)19-8-9-20-18-7-6-16-14-17(25)10-12-22(16,2)21(18)11-13-23(19,20)3/h10,12,14-15,18-21H,6-9,11,13H2,1-5H3/t15-,18-,19+,20-,21-,22-,23+/m0/s1
InChIKey SGBLZTLTOQYIDO-CZWIXHKBSA-N
Molecular Weight 341.539 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
SPLASH splash10-00di-9001000000-d0e575b48e24d1544e3f
Source of Spectrum AC-1984-75-0
Wiley ID 1336112