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5-(p-nitrophenyl)-2-{{[m-(trifluoromethyl)benzyl]sulfonyl}methyl}thiazole
SpectraBase Compound ID JU2jka7lY8J
InChI InChI=1S/C18H13F3N2O4S2/c19-18(20,21)14-3-1-2-12(8-14)10-29(26,27)11-17-22-9-16(28-17)13-4-6-15(7-5-13)23(24)25/h1-9H,10-11H2
InChIKey NJMGUVQZWZQMLK-UHFFFAOYSA-N
Mol Weight 442.43 g/mol
Molecular Formula C18H13F3N2O4S2
Exact Mass 442.026884 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Pq2unoHXMf
Name 5-(p-nitrophenyl)-2-{{[m-(trifluoromethyl)benzyl]sulfonyl}methyl}thiazole
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Formula C18H13F3N2O4S2
InChI InChI=1S/C18H13F3N2O4S2/c19-18(20,21)14-3-1-2-12(8-14)10-29(26,27)11-17-22-9-16(28-17)13-4-6-15(7-5-13)23(24)25/h1-9H,10-11H2
InChIKey NJMGUVQZWZQMLK-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 57321M
Solvent Polysol