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5-chloro-1,3-dimethyl-alpha,alpha,alpha,alpha',lapha',alpha'-hexafluoropyrazole-4-sulfono-3',5'-xylidide

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

5-chloro-1,3-dimethyl-alpha,alpha,alpha,alpha',lapha',alpha'-hexafluoropyrazole-4-sulfono-3',5'-xylidide
SpectraBase Compound ID J93agrl7TST
InChI InChI=1S/C13H10ClF6N3O2S/c1-6-10(11(14)23(2)21-6)26(24,25)22-9-4-7(12(15,16)17)3-8(5-9)13(18,19)20/h3-5,22H,1-2H3
InChIKey LDABGPHHZAJSQO-UHFFFAOYSA-N
Mol Weight 421.75 g/mol
Molecular Formula C13H10ClF6N3O2S
Exact Mass 421.008644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9CKwosmHXp3
Name 5-CHLORO-1,3-DIMETHYL-alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUOROPYRAZOLE-4-SULFONO-3',5'-XYLIDIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10ClF6N3O2S
InChI InChI=1S/C13H10ClF6N3O2S/c1-6-10(11(14)23(2)21-6)26(24,25)22-9-4-7(12(15,16)17)3-8(5-9)13(18,19)20/h3-5,22H,1-2H3
InChIKey LDABGPHHZAJSQO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 421.75
Solvent CDCl3; Reference=TMS; Temperature 297K