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ENDO-2-BROMO-5-THIABICYCLO-[2.1.1]-HEXANE

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ENDO-2-BROMO-5-THIABICYCLO-[2.1.1]-HEXANE
SpectraBase Compound ID KDOJbkUfx0n
InChI InChI=1S/C5H7BrS/c6-4-1-3-2-5(4)7-3/h3-5H,1-2H2/t3-,4-,5-/m1/s1
InChIKey IBADFWOKSOFICZ-UOWFLXDJSA-N
Mol Weight 179.07 g/mol
Molecular Formula C5H7BrS
Exact Mass 177.945184 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3eNJWPGyBLd
Name ENDO-2-BROMO-5-THIABICYCLO-[2.1.1]-HEXANE
Compound Number 1 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H7BrS
InChI InChI=1S/C5H7BrS/c6-4-1-3-2-5(4)7-3/h3-5H,1-2H2/t3-,4-,5-/m1/s1
InChIKey IBADFWOKSOFICZ-UOWFLXDJSA-N
Literature Reference Author E.BLOCK,M.THIRUVAZHI,P.J.TOSCANO,T.BAYER,S.GRISONI,S.H.ZHAO
Literature Reference Citation J.AM.CHEM.SOC.,118,2790(1996)
Literature Reference DOI 10.1021/ja951134t
Molecular Weight 179.075 g/mol
Sample ID 57071
Solvent CDCl3