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ANDROST-4-ENE-6.BETA.,15.BETA.-DIOL-3-ONE(6.BETA.,15.BETA.-DI-ACETATE)
SpectraBase Compound ID 1buVQJUMHGN
InChI InChI=1S/C23H32O5/c1-13(24)27-19-7-9-22(3)8-6-17-16(21(19)22)12-20(28-14(2)25)18-11-15(26)5-10-23(17,18)4/h11,16-17,19-21H,5-10,12H2,1-4H3/t16-,17+,19-,20-,21-,22-,23-/m1/s1
InChIKey SBUKPIGKDWGITD-HAMQGEPFSA-N
Mol Weight 388.5 g/mol
Molecular Formula C23H32O5
Exact Mass 388.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBZ0gcrN28Y
Name ANDROST-4-ENE-6.BETA.,15.BETA.-DIOL-3-ONE(6.BETA.,15.BETA.-DI-ACETATE)
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 388.224974125 u
Formula C23H32O5
InChI InChI=1S/C23H32O5/c1-13(24)27-19-7-9-22(3)8-6-17-16(21(19)22)12-20(28-14(2)25)18-11-15(26)5-10-23(17,18)4/h11,16-17,19-21H,5-10,12H2,1-4H3/t16-,17+,19-,20-,21-,22-,23-/m1/s1
InChIKey SBUKPIGKDWGITD-HAMQGEPFSA-N
Molecular Weight 388.504 g/mol
Nominal Mass 388 u
Number of Peaks 89
SMILES C1(CC[C@@]2([C@]3(CC[C@@]4(CC[C@]([C@]4([C@@]3(C[C@](C2=C1)(OC(C)=O)[H])[H])[H])(OC(C)=O)[H])C)[H])C)=O
SPLASH splash10-0002-1219000000-800c96cdcbf70b4f0446
Source File Reference LMCM-52316-391R
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 15-(ACETYLOXY)-3-OXOANDROST-4-EN-6-YL ACETATE (6R,8R,9S,10R,13R,14S,15R)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-6,15-diyl diacetate
Wiley ID 4_2415