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2-CYANO-1,4,6-ANDROSTATRIENE-3,17-DIONE

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2-CYANO-1,4,6-ANDROSTATRIENE-3,17-DIONE
SpectraBase Compound ID DoLY66vMbxo
InChI InChI=1S/C20H21NO2/c1-19-8-7-16-14(15(19)5-6-18(19)23)4-3-13-9-17(22)12(11-21)10-20(13,16)2/h3-4,9-10,14-16H,5-8H2,1-2H3/t14-,15-,16-,19-,20-/m0/s1
InChIKey IDOVLVFTZXIEBK-UKSSEWCLSA-N
Mol Weight 307.39 g/mol
Molecular Formula C20H21NO2
Exact Mass 307.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HgDZvw5UmEd
Name 2-CYANO-1,4,6-ANDROSTATRIENE-3,17-DIONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H21NO2
InChI InChI=1S/C20H21NO2/c1-19-8-7-16-14(15(19)5-6-18(19)23)4-3-13-9-17(22)12(11-21)10-20(13,16)2/h3-4,9-10,14-16H,5-8H2,1-2H3/t14-,15-,16-,19-,20-/m0/s1
InChIKey IDOVLVFTZXIEBK-UKSSEWCLSA-N
Literature Reference Author M.KIM,E.MA
Literature Reference Citation MOLECULES,15,4408(2010)
Literature Reference DOI 10.3390/molecules15064408
Molecular Weight 307.392 g/mol
Sample ID 71014
Solvent DMSO-D6