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

*Links on SpectraBase are not permalinks.
4-METHYL-N-(5-TRIFLUOROMETHYL)-1H-1,2,4-TRIAZOL-3-YL-BENZENESULFONAMIDE
SpectraBase Compound ID LjPeTyQzaQ
InChI InChI=1S/2C10H9F3N4O2S/c2*1-6-2-4-7(5-3-6)20(18,19)17-9-14-8(15-16-9)10(11,12)13/h2*2-5H,1H3,(H2,14,15,16,17)
InChIKey NQZRSNZUVNYETM-UHFFFAOYSA-N
Mol Weight 612.53 g/mol
Molecular Formula C20H18F6N8O4S2
Exact Mass 612.079662 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F 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 GEVWi4fg8nS
Name 4-METHYL-N-(5-TRIFLUOROMETHYL)-1H-1,2,4-TRIAZOL-3-YL-BENZENESULFONAMIDE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18F6N8O4S2
InChI InChI=1S/2C10H9F3N4O2S/c2*1-6-2-4-7(5-3-6)20(18,19)17-9-14-8(15-16-9)10(11,12)13/h2*2-5H,1H3,(H2,14,15,16,17)
InChIKey NQZRSNZUVNYETM-UHFFFAOYSA-N
Literature Reference Author N.BOECHAT,L.C.S.PINHEIRO,O.A.SANTOS-FILHO,I.C.SILVA
Literature Reference Citation MOLECULES,16,8083(2011)
Literature Reference DOI 10.3390/molecules16098083
Solvent DMSO-D6
Source File Reference UWBT225