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4-(p-TOLYLSULFONYL)-5-THIAZOLETHIOL, alpha,alpha,alpha-TRIFLUORO-p-TOLUATE (ESTER)

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

4-(p-TOLYLSULFONYL)-5-THIAZOLETHIOL, alpha,alpha,alpha-TRIFLUORO-p-TOLUATE (ESTER)
SpectraBase Compound ID FWrGN0tK5Zv
InChI InChI=1S/C18H12F3NO3S3/c1-11-2-8-14(9-3-11)28(24,25)15-17(26-10-22-15)27-16(23)12-4-6-13(7-5-12)18(19,20)21/h2-10H,1H3
InChIKey PXUZVZANUHUAQO-UHFFFAOYSA-N
Mol Weight 443.47 g/mol
Molecular Formula C18H12F3NO3S3
Exact Mass 442.993141 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2LMhaBjYvL2
Name 4-(p-TOLYLSULFONYL)-5-THIAZOLETHIOL, alpha,alpha,alpha-TRIFLUORO-p-TOLUATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12F3NO3S3
InChI InChI=1S/C18H12F3NO3S3/c1-11-2-8-14(9-3-11)28(24,25)15-17(26-10-22-15)27-16(23)12-4-6-13(7-5-12)18(19,20)21/h2-10H,1H3
InChIKey PXUZVZANUHUAQO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 206-208C
Molecular Weight 443.49
Solvent DMSO-d6; Reference=TMS; Temperature 297K