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[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3-chlorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-
SpectraBase Compound ID 1zsW5UFQspe
InChI InChI=1S/C16H15ClN6S/c1-9(2)6-12-8-13(19-18-12)14-20-21-16-23(14)22-15(24-16)10-4-3-5-11(17)7-10/h3-5,7-9H,6H2,1-2H3,(H,18,19)
InChIKey VJRNHVIWDMEYBR-UHFFFAOYSA-N
Mol Weight 358.85 g/mol
Molecular Formula C16H15ClN6S
Exact Mass 358.076743 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4wo3e350x4W
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3-chlorophenyl)-3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-
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/C16H15ClN6S/c1-9(2)6-12-8-13(19-18-12)14-20-21-16-23(14)22-15(24-16)10-4-3-5-11(17)7-10/h3-5,7-9H,6H2,1-2H3,(H,18,19)
InChIKey VJRNHVIWDMEYBR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10888
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: F40648; Labnumber: BAL4-7175
Temperature 315 °C