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

*Links on SpectraBase are not permalinks.

3-(NITROMETHYL)-4-p-TOLYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOLE

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

3-(NITROMETHYL)-4-p-TOLYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOLE
SpectraBase Compound ID 9ewfr9Jf50a
InChI InChI=1S/C11H9F3N4O2/c1-7-2-4-8(5-3-7)18-9(6-17(19)20)15-16-10(18)11(12,13)14/h2-5H,6H2,1H3
InChIKey UMWNSKUNMDOWCF-UHFFFAOYSA-N
Mol Weight 286.21 g/mol
Molecular Formula C11H9F3N4O2
Exact Mass 286.06776 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 3GKqkfb7WCr
Name 3-(NITROMETHYL)-4-p-TOLYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOLE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9F3N4O2
InChI InChI=1S/C11H9F3N4O2/c1-7-2-4-8(5-3-7)18-9(6-17(19)20)15-16-10(18)11(12,13)14/h2-5H,6H2,1H3
InChIKey UMWNSKUNMDOWCF-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 97-99C
Molecular Weight 286.21
Solvent CDCl3; Reference=TMS; Temperature 297K