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(Z)-17-BETA-HYDROXY-5-ALPHA-ANDROSTAN-3-ONE-O-(2-IODOETHYL)-OXIME
SpectraBase Compound ID IwWORgrAJcT
InChI InChI=1S/C21H34INO2/c1-20-9-7-15(23-25-12-11-22)13-14(20)3-4-16-17-5-6-19(24)21(17,2)10-8-18(16)20/h14,16-19,24H,3-13H2,1-2H3/b23-15-/t14-,16-,17-,18-,19-,20-,21-/m0/s1
InChIKey QSYYRKTZKQONND-HSKIFQEVSA-N
Mol Weight 459.4 g/mol
Molecular Formula C21H34INO2
Exact Mass 459.163424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID In4ARjKHGz9
Name (Z)-17-BETA-HYDROXY-5-ALPHA-ANDROSTAN-3-ONE-O-(2-IODOETHYL)-OXIME
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34INO2
InChI InChI=1S/C21H34INO2/c1-20-9-7-15(23-25-12-11-22)13-14(20)3-4-16-17-5-6-19(24)21(17,2)10-8-18(16)20/h14,16-19,24H,3-13H2,1-2H3/b23-15-/t14-,16-,17-,18-,19-,20-,21-/m0/s1
InChIKey QSYYRKTZKQONND-HSKIFQEVSA-N
Literature Reference Author G.J.ELLAMES,D.JOHNSTON,D.I.SMITH
Literature Reference Citation J.HETCYCL.CHEM.,27,1091(1990)
Literature Reference DOI 10.1002/jhet.5570270451
Molecular Weight 459.411 g/mol
Solvent CDCl3
Source File Reference UWMZ1174