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6-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furyl}-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID KkL43Vv6kYH
InChI InChI=1S/C12H6ClF3N6OS/c13-6-3-17-21(4-6)5-7-1-2-8(23-7)9-20-22-10(12(14,15)16)18-19-11(22)24-9/h1-4H,5H2
InChIKey GMZUOJAIFXHYAY-UHFFFAOYSA-N
Mol Weight 374.73 g/mol
Molecular Formula C12H6ClF3N6OS
Exact Mass 373.996442 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LicnUuhRNG8
Name 6-{5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furyl}-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C12H6ClF3N6OS/c13-6-3-17-21(4-6)5-7-1-2-8(23-7)9-20-22-10(12(14,15)16)18-19-11(22)24-9/h1-4H,5H2
InChIKey GMZUOJAIFXHYAY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33860
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1996659; SBI_ID: SBI-033864
Temperature 318 °C