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3-BETA-17-BETA-BIS-(ACETYLOXY)-ANDROST-5-EN-7-ONE
SpectraBase Compound ID 3nSHhsXIfHE
InChI InChI=1S/C23H32O5/c1-13(24)27-16-7-9-22(3)15(11-16)12-19(26)21-17-5-6-20(28-14(2)25)23(17,4)10-8-18(21)22/h12,16-18,20-21H,5-11H2,1-4H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1
InChIKey UCLVTARKINLGLA-GSLJADNHSA-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 3aT1I9uAmT6
Name 3.BETA.,17.BETA.-DIACETOXY-ANDROST-5-ENE-7-ONE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 388.224974125 u
Formula C23H32O5
InChI InChI=1S/C23H32O5/c1-13(24)27-16-7-9-22(3)15(11-16)12-19(26)21-17-5-6-20(28-14(2)25)23(17,4)10-8-18(21)22/h12,16-18,20-21H,5-11H2,1-4H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1
InChIKey UCLVTARKINLGLA-GSLJADNHSA-N
Molecular Weight 388.504 g/mol
Nominal Mass 388 u
Number of Peaks 70
SMILES [C@]1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(C(C=C2C1)=O)[H])[H])(OC(=O)C)[H])C)[H])C)(OC(=O)C)[H]
SPLASH splash10-004l-9515000000-4eacea5e2b7da1941d9f
Source File Reference LMCM-50432-010X
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms 17-(ACETYLOXY)-7-OXOANDROST-5-EN-3-YL ACETATE (3S,8R,9S,10R,13S,14S,17S)-10,13-dimethyl-7-oxo-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyl diacetate
Wiley ID 4_138