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[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-3-[(phenylthio)methyl]-
SpectraBase Compound ID 2KK2kStMdpl
InChI InChI=1S/C17H18N6S2/c1-11(2)8-12-9-14(19-18-12)16-22-23-15(20-21-17(23)25-16)10-24-13-6-4-3-5-7-13/h3-7,9,11H,8,10H2,1-2H3,(H,18,19)
InChIKey HNQKCEWVBBITAN-UHFFFAOYSA-N
Mol Weight 370.49 g/mol
Molecular Formula C17H18N6S2
Exact Mass 370.103437 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9nwXgfreb9g
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[3-(2-methylpropyl)-1H-pyrazol-5-yl]-3-[(phenylthio)methyl]-
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/C17H18N6S2/c1-11(2)8-12-9-14(19-18-12)16-22-23-15(20-21-17(23)25-16)10-24-13-6-4-3-5-7-13/h3-7,9,11H,8,10H2,1-2H3,(H,18,19)
InChIKey HNQKCEWVBBITAN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4913
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: F23430; Labnumber: BAL4-9397