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[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-6-[(E)-2-phenylethenyl]-
SpectraBase Compound ID IHegaGgR4FI
InChI InChI=1S/C18H18N6S/c1-12(2)10-14-11-15(20-19-14)17-21-22-18-24(17)23-16(25-18)9-8-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,19,20)/b9-8+
InChIKey ZUQLQNHHKDZRKP-CMDGGOBGSA-N
Mol Weight 350.44 g/mol
Molecular Formula C18H18N6S
Exact Mass 350.131366 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8rjMRoyQYUP
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-6-[(E)-2-phenylethenyl]-
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/C18H18N6S/c1-12(2)10-14-11-15(20-19-14)17-21-22-18-24(17)23-16(25-18)9-8-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3,(H,19,20)/b9-8+
InChIKey ZUQLQNHHKDZRKP-CMDGGOBGSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10904
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: F40673; Labnumber: BAL4-7241
Temperature 315 °C