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[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-6-(1-naphthalenylmethyl)-
SpectraBase Compound ID 6MyGDHLv1zk
InChI InChI=1S/C21H20N6S/c1-13(2)10-16-12-18(23-22-16)20-24-25-21-27(20)26-19(28-21)11-15-8-5-7-14-6-3-4-9-17(14)15/h3-9,12-13H,10-11H2,1-2H3,(H,22,23)
InChIKey RANAPWAKKMRPAA-UHFFFAOYSA-N
Mol Weight 388.49 g/mol
Molecular Formula C21H20N6S
Exact Mass 388.147016 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HccKlEvJLUc
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-6-(1-naphthalenylmethyl)-
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/C21H20N6S/c1-13(2)10-16-12-18(23-22-16)20-24-25-21-27(20)26-19(28-21)11-15-8-5-7-14-6-3-4-9-17(14)15/h3-9,12-13H,10-11H2,1-2H3,(H,22,23)
InChIKey RANAPWAKKMRPAA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10898
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: F40661; Labnumber: BAL4-7206
Temperature 315 °C