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3-(BUT-2-ENYL)-5-(4-CHLOROPHENYL)-3-TRIFLUOROMETHYL-3H-THIOPHEN-2-ONE
SpectraBase Compound ID 5EqTbwoFCk0
InChI InChI=1S/C15H12ClF3OS/c1-2-3-8-14(15(17,18)19)9-12(21-13(14)20)10-4-6-11(16)7-5-10/h2-7,9H,8H2,1H3/b3-2+
InChIKey LQGUYYSRYJZSQZ-NSCUHMNNSA-N
Mol Weight 332.77 g/mol
Molecular Formula C15H12ClF3OS
Exact Mass 332.024948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cRGyybaNcD
Name 3-(BUT-2-ENYL)-5-(4-CHLOROPHENYL)-3-TRIFLUOROMETHYL-3H-THIOPHEN-2-ONE
Compound Number 12B
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Formula C15H12ClF3OS
InChI InChI=1S/C15H12ClF3OS/c1-2-3-8-14(15(17,18)19)9-12(21-13(14)20)10-4-6-11(16)7-5-10/h2-7,9H,8H2,1H3/b3-2+
InChIKey LQGUYYSRYJZSQZ-NSCUHMNNSA-N
Literature Reference Author K.BURGER,L.HENNIG,A.FUCHS,D.GREIF,J.SPENGLER,F.ALBERICIO
Literature Reference Citation MH.CHEM.,136,1763(2005)
Literature Reference DOI 10.1007/s00706-005-0366-z
Molecular Weight 332.768 g/mol
Solvent CDCl3
Source File Reference UWSI24211