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(1S,2R,5S)-4-METHYL-2-[(1R)-PHENYLETHOXY]-6-TRIBUTYLSTANNYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
SpectraBase Compound ID DWFilrTGtkh
InChI InChI=1S/C16H17O3.3C4H9.Sn/c1-10-13-8-9-14(19-13)16(15(10)17)18-11(2)12-6-4-3-5-7-12;3*1-3-4-2;/h3-7,9-11,13-14,16H,1-2H3;3*1,3-4H2,2H3;/t10-,11+,13+,14-,16+;;;;/m0..../s1
InChIKey NQJAENIGLUHSPP-WVQMXQPLSA-N
Mol Weight 547.4 g/mol
Molecular Formula C28H44O3Sn
Exact Mass 548.231247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GqnXYfJuNHQ
Name (1S,2R,5S)-4-METHYL-2-[(1R)-PHENYLETHOXY]-6-TRIBUTYLSTANNYL-8-OXABICYCLO-[3.2.1]-OCT-6-EN-3-ONE
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H44O3Sn
InChI InChI=1S/C16H17O3.3C4H9.Sn/c1-10-13-8-9-14(19-13)16(15(10)17)18-11(2)12-6-4-3-5-7-12;3*1-3-4-2;/h3-7,9-11,13-14,16H,1-2H3;3*1,3-4H2,2H3;/t10-,11+,13+,14-,16+;;;;/m0..../s1
InChIKey NQJAENIGLUHSPP-WVQMXQPLSA-N
Literature Reference Author H.BECK,C.B.W.STARK,H.M.R.HOFFMANN
Literature Reference Citation ORG.LETTERS,2,883(2000)
Literature Reference DOI 10.1021/ol991386p
Molecular Weight 547.346 g/mol
Solvent CDCl3
Source File Reference UWLU33412