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2,2,7-ALPHA-TRIBROMO-17-BETA-ACETOXYANDROST-4-EN-3,6-DIONE
SpectraBase Compound ID KyxOK0nH1sc
InChI InChI=1S/C21H25Br3O4/c1-10(25)28-15-5-4-11-16-12(6-7-19(11,15)2)20(3)9-21(23,24)14(26)8-13(20)18(27)17(16)22/h8,11-12,15-17H,4-7,9H2,1-3H3/t11-,12-,15-,16-,17-,19-,20+/m0/s1
InChIKey BOJRHZHWSOALPP-WJVIRGJQSA-N
Mol Weight 581.14 g/mol
Molecular Formula C21H25Br3O4
Exact Mass 577.930298 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JLLFWaIPX88
Name 2,2,7-ALPHA-TRIBROMO-17-BETA-ACETOXYANDROST-4-EN-3,6-DIONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H25Br3O4
InChI InChI=1S/C21H25Br3O4/c1-10(25)28-15-5-4-11-16-12(6-7-19(11,15)2)20(3)9-21(23,24)14(26)8-13(20)18(27)17(16)22/h8,11-12,15-17H,4-7,9H2,1-3H3/t11-,12-,15-,16-,17-,19-,20+/m0/s1
InChIKey BOJRHZHWSOALPP-WJVIRGJQSA-N
Literature Reference Author T.SHIMIZU,A.TOBARI,J.KOYANAGI,M.KAWASE,S.SAITO
Literature Reference Citation CHEM.PHARM.BULL.,49,23(2001)
Literature Reference DOI 10.1248/cpb.49.23
Molecular Weight 581.139 g/mol
Solvent CDCl3
Source File Reference UWLU31703