For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2,5-DIBROMO-alpha,alpha,alpha-TRIFLUORO-3-THIOPHENECARBOXY-m-TOLUIDIDE

View entire compound with spectra: 3 NMR, and 1 FTIR

2,5-DIBROMO-alpha,alpha,alpha-TRIFLUORO-3-THIOPHENECARBOXY-m-TOLUIDIDE
SpectraBase Compound ID LcHCABdJNDq
InChI InChI=1S/C13H8Br2F3NOS/c14-10-4-7(12(15)21-10)5-11(20)19-9-3-1-2-8(6-9)13(16,17)18/h1-4,6H,5H2,(H,19,20)
InChIKey OYMIBNFJGDBLQB-UHFFFAOYSA-N
Mol Weight 443.08 g/mol
Molecular Formula C13H8Br2F3NOS
Exact Mass 440.864546 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID APr8tc5vQAS
Name 2,5-DIBROMO-alpha,alpha,alpha-TRIFLUORO-3-THIOPHENECARBOXY-m-TOLUIDIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8Br2F3NOS
InChI InChI=1S/C13H8Br2F3NOS/c14-10-4-7(12(15)21-10)5-11(20)19-9-3-1-2-8(6-9)13(16,17)18/h1-4,6H,5H2,(H,19,20)
InChIKey OYMIBNFJGDBLQB-UHFFFAOYSA-N
Melting Point 129-132C
Molecular Weight 443.09
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 3-THIOPHENECARBOXY-m-TOLUIDIDE, 2,5-DIBROMO-alpha,alpha,alpha-TRIFLUORO-,