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[(4-METHYLPENTAN-2-YL)-SULFONYL]-BENZENE
SpectraBase Compound ID IHMsIkTcPvQ
InChI InChI=1S/C12H18O2S/c1-4-10(2)11(3)15(13,14)12-8-6-5-7-9-12/h5-11H,4H2,1-3H3/t10?,11-/m0/s1
InChIKey HUDPSUIGDREYPU-DTIOYNMSSA-N
Mol Weight 226.33 g/mol
Molecular Formula C12H18O2S
Exact Mass 226.102751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6fnEHU3FX0U
Name [(4-METHYLPENTAN-2-YL)-SULFONYL]-BENZENE
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O2S
InChI InChI=1S/C12H18O2S/c1-4-10(2)11(3)15(13,14)12-8-6-5-7-9-12/h5-11H,4H2,1-3H3/t10?,11-/m0/s1
InChIKey HUDPSUIGDREYPU-DTIOYNMSSA-N
Literature Reference Author T.HEB,G.RAABE,H.J.GAIS
Literature Reference Citation EUR.J.ORG.CHEM.,2014,7134(2014)
Literature Reference DOI 10.1002/ejoc.201402896
Molecular Weight 226.334 g/mol
Solvent CDCl3
Source File Reference UWLU85495