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5-(p-chlorophenyl)-2-{{[m-trifluoromethyl)benzyl]sulfonyl}methyl}thiazole

View entire compound with spectra: 2 NMR, and 1 FTIR

5-(p-chlorophenyl)-2-{{[m-trifluoromethyl)benzyl]sulfonyl}methyl}thiazole
SpectraBase Compound ID BJyzFXwj8ky
InChI InChI=1S/C18H13ClF3NO2S2/c19-15-6-4-13(5-7-15)16-9-23-17(26-16)11-27(24,25)10-12-2-1-3-14(8-12)18(20,21)22/h1-9H,10-11H2
InChIKey LSVFVGKTTMHNGC-UHFFFAOYSA-N
Mol Weight 431.88 g/mol
Molecular Formula C18H13ClF3NO2S2
Exact Mass 431.002833 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HNYCuQXDkzK
Name 5-(p-CHLOROPHENYL)-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 C18H13ClF3NO2S2
InChI InChI=1S/C18H13ClF3NO2S2/c19-15-6-4-13(5-7-15)16-9-23-17(26-16)11-27(24,25)10-12-2-1-3-14(8-12)18(20,21)22/h1-9H,10-11H2
InChIKey LSVFVGKTTMHNGC-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 120-122C
Molecular Weight 431.89
Solvent CDCl3; Reference=TMS; Temperature 297K