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(5S)-2-METHYLTHIO-3-THIA-1-AZABICYCLO-[3.3.0]-OCT-1-EN-1-IUMIODIDE
SpectraBase Compound ID 3zGebKtZO7r
InChI InChI=1S/C7H12NS2.HI/c1-9-7-8-4-2-3-6(8)5-10-7;/h6H,2-5H2,1H3;1H/q+1;/p-1/t6-;/m1./s1
InChIKey WFISEBZYJPEQOD-FYZOBXCZSA-M
Mol Weight 301.2 g/mol
Molecular Formula C7H12INS2
Exact Mass 300.945587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2g26J5tzbAA
Name (5S)-2-METHYLTHIO-3-THIA-1-AZABICYCLO-[3.3.0]-OCT-1-EN-1-IUMIODIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12INS2
InChI InChI=1S/C7H12NS2.HI/c1-9-7-8-4-2-3-6(8)5-10-7;/h6H,2-5H2,1H3;1H/q+1;/p-1/t6-;/m1./s1
InChIKey WFISEBZYJPEQOD-FYZOBXCZSA-M
Literature Reference Author R.A.AITKEN,D.P.ARMSTRONG,R.H.B.GALT,S.T.E.MESHER
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2139(1997)
Literature Reference DOI 10.1039/a700521k
Molecular Weight 301.203 g/mol
Solvent CDCl3
Source File Reference UWRU7834