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2-{2-[3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 8G0potv3DcE
InChI InChI=1S/C23H21N5O2S/c1-23(2,3)15-10-8-14(9-11-15)19-24-25-22-28(19)26-18(31-22)12-13-27-20(29)16-6-4-5-7-17(16)21(27)30/h4-11H,12-13H2,1-3H3
InChIKey YONDCVIHJNVFPG-UHFFFAOYSA-N
Mol Weight 431.51 g/mol
Molecular Formula C23H21N5O2S
Exact Mass 431.141596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LmNJSZ50HiX
Name 2-{2-[3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1H-isoindole-1,3(2H)-dione
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/C23H21N5O2S/c1-23(2,3)15-10-8-14(9-11-15)19-24-25-22-28(19)26-18(31-22)12-13-27-20(29)16-6-4-5-7-17(16)21(27)30/h4-11H,12-13H2,1-3H3
InChIKey YONDCVIHJNVFPG-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19376
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: D13379; Labnumber: GRES-04927; SBI_ID: SBI-019379
Temperature 308 °C