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2-Iodo-3-nor-2,3-secocholestane 4a,1'-lactone
SpectraBase Compound ID Hj1dArTb5JN
InChI InChI=1S/C28H47IO2/c1-19(2)7-6-8-20(3)22-9-10-23-21-11-14-28(17-25(30)31-18-28)27(5,15-16-29)24(21)12-13-26(22,23)4/h19-24H,6-18H2,1-5H3
InChIKey DWNYPAJWTZSGSL-UHFFFAOYSA-N
Mol Weight 542.6 g/mol
Molecular Formula C28H47IO2
Exact Mass 542.262076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LehBJIrXzwb
Name 2-Iodo-3-nor-2,3-secocholestane 4a,1'-lactone
Comments 50.3 MHZ OR 20.1 MHZ SPECTRUM
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Formula C28H47IO2
InChI InChI=1S/C28H47IO2/c1-19(2)7-6-8-20(3)22-9-10-23-21-11-14-28(17-25(30)31-18-28)27(5,15-16-29)24(21)12-13-26(22,23)4/h19-24H,6-18H2,1-5H3
InChIKey DWNYPAJWTZSGSL-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference M.T. Arencibia, R. Freire, E. Suarez, J. Chem. Soc. Perkin I 3349 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3