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

*Links on SpectraBase are not permalinks.
1-[2-(5-CHLORO-1,3-DIMETHYLPYRAZOL-4-YL)VINYL]-3-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)UREA
SpectraBase Compound ID 4Ib71LvsZwx
InChI InChI=1S/C16H13ClF6N4O/c1-8-12(13(17)27(2)26-8)3-4-24-14(28)25-11-6-9(15(18,19)20)5-10(7-11)16(21,22)23/h3-7H,1-2H3,(H2,24,25,28)
InChIKey VHEWEAWJUSHWMG-UHFFFAOYSA-N
Mol Weight 426.75 g/mol
Molecular Formula C16H13ClF6N4O
Exact Mass 426.068208 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 8mOIxSIUwky
Name 1-[2-(5-CHLORO-1,3-DIMETHYLPYRAZOL-4-YL)VINYL]-3-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)UREA
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClF6N4O
InChI InChI=1S/C16H13ClF6N4O/c1-8-12(13(17)27(2)26-8)3-4-24-14(28)25-11-6-9(15(18,19)20)5-10(7-11)16(21,22)23/h3-7H,1-2H3,(H2,24,25,28)
InChIKey VHEWEAWJUSHWMG-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 203-205C
Molecular Weight 426.75
Solvent DMSO-d6; Reference=TMS; Temperature 297K