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4-[3-(4-tert-butylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]-1,2-benzenediol
SpectraBase Compound ID IXdgWBM361t
InChI InChI=1S/C20H20N4O2S/c1-20(2,3)14-7-4-12(5-8-14)18-21-22-19-24(18)23-15(11-27-19)13-6-9-16(25)17(26)10-13/h4-10,25-26H,11H2,1-3H3
InChIKey XBJPFSLYNLYOET-UHFFFAOYSA-N
Mol Weight 380.47 g/mol
Molecular Formula C20H20N4O2S
Exact Mass 380.130697 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BU5C9Zeelgx
Name 4-[3-(4-tert-butylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl]-1,2-benzenediol
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/C20H20N4O2S/c1-20(2,3)14-7-4-12(5-8-14)18-21-22-19-24(18)23-15(11-27-19)13-6-9-16(25)17(26)10-13/h4-10,25-26H,11H2,1-3H3
InChIKey XBJPFSLYNLYOET-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19671
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: D14306; Labnumber: UDSG-00790; SBI_ID: SBI-019675
Temperature 313 °C