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INLDLSZSIDBESL-UHFFFAOYSA-N
SpectraBase Compound ID GCbN00aqkzF
InChI InChI=1S/C14H14Cl2N2OS/c1-20-14-17-8-10(18-14)3-2-4-13(19)11-6-5-9(15)7-12(11)16/h5-8H,2-4H2,1H3,(H,17,18)
InChIKey INLDLSZSIDBESL-UHFFFAOYSA-N
Mol Weight 329.25 g/mol
Molecular Formula C14H14Cl2N2OS
Exact Mass 328.02039 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BZxleBPQ4dV
Name 1-(2,4-DICHLOROPHENYL)-3-(2-METHYLTHIO-5-IMIDAZOLYL)-1-BUTANONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14Cl2N2OS
InChI InChI=1S/C14H14Cl2N2OS/c1-20-14-17-8-10(18-14)3-2-4-13(19)11-6-5-9(15)7-12(11)16/h5-8H,2-4H2,1H3,(H,17,18)
InChIKey INLDLSZSIDBESL-UHFFFAOYSA-N
Literature Reference Author J.J.LEE,L.F.HUANG,K.ZAW,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,35,81(1998)
Literature Reference DOI 10.1002/jhet.5570350116
Molecular Weight 329.244 g/mol
Solvent CDCl3
Source File Reference UWCS25556