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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) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 47qPgUyY4Gn
Name 5-(p-NITROPHENYL)-2-{{[m-(TRIFLUOROMETHYL)BENZYL]SULFONYL}METHYL}THIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 BRUKER AC-300
Melting Point 183-185C
Molecular Weight 442.44
Solvent Polysol; Reference=TMS; Temperature 297K