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(E)-2-(4-CHLOROBENZENESULFENYL)-3-CHLORO-4,4-DIMETHYL-2-PENTENE
SpectraBase Compound ID KX3oMO1ozPO
InChI InChI=1S/C13H16Cl2S/c1-9(12(15)13(2,3)4)16-11-7-5-10(14)6-8-11/h5-8H,1-4H3/b12-9+
InChIKey WQNGRTTYTVIILF-FMIVXFBMSA-N
Mol Weight 275.24 g/mol
Molecular Formula C13H16Cl2S
Exact Mass 274.034977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaR1kpdCDXg
Name (E)-2-(4-CHLOROBENZENESULFENYL)-3-CHLORO-4,4-DIMETHYL-2-PENTENE
CAS Registry Number 58866-44-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16Cl2S
InChI InChI=1S/C13H16Cl2S/c1-9(12(15)13(2,3)4)16-11-7-5-10(14)6-8-11/h5-8H,1-4H3/b12-9+
InChIKey WQNGRTTYTVIILF-FMIVXFBMSA-N
Literature Reference Author G.H.SCHMID,A.MODRO,F.LENZ,D.G.GARRATT,K.YATES
Literature Reference Citation J.ORG.CHEM.,41,13(1976)
Literature Reference DOI 10.1021/jo00863a003
Molecular Weight 275.236 g/mol
Solvent CDCl3
Source File Reference UWCS11422