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4-PARA-TOLYL-6,7-DIPHENYL-2,2-BIS(TRIFLUOROMETHYL)-5,1,3-THIADIAZABICYCLO[4.1.0]HEPT-3-ENE
SpectraBase Compound ID D5C3E3RMPLH
InChI InChI=1S/C25H18F6N2S/c1-16-12-14-18(15-13-16)21-32-23(24(26,27)28,25(29,30)31)33-20(17-8-4-2-5-9-17)22(33,34-21)19-10-6-3-7-11-19/h2-15,20H,1H3
InChIKey FIRUYINPZUFYBK-UHFFFAOYSA-N
Mol Weight 492.48 g/mol
Molecular Formula C25H18F6N2S
Exact Mass 492.109489 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AVNC2u0GixU
Name 4-PARA-TOLYL-6,7-DIPHENYL-2,2-BIS(TRIFLUOROMETHYL)-5,1,3-THIADIAZABICYCLO[4.1.0]HEPT-3-ENE
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Formula C25H18F6N2S
InChI InChI=1S/C25H18F6N2S/c1-16-12-14-18(15-13-16)21-32-23(24(26,27)28,25(29,30)31)33-20(17-8-4-2-5-9-17)22(33,34-21)19-10-6-3-7-11-19/h2-15,20H,1H3
InChIKey FIRUYINPZUFYBK-UHFFFAOYSA-N
Instrument Name Jeol C-60 HL
Literature Reference KLAUS BURGER, THOMAS KAHL (1989) J.Fluor.Chem.: v.42, N1, 51-58.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d