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[3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl 4-chlorophenyl ether

View entire compound with spectra: 1 NMR

[3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl 4-chlorophenyl ether
SpectraBase Compound ID AOEmvADrLqw
InChI InChI=1S/C20H19ClN4OS/c1-20(2,3)14-6-4-13(5-7-14)18-22-23-19-25(18)24-17(27-19)12-26-16-10-8-15(21)9-11-16/h4-11H,12H2,1-3H3
InChIKey WRQZDZJSGYTELJ-UHFFFAOYSA-N
Mol Weight 398.91 g/mol
Molecular Formula C20H19ClN4OS
Exact Mass 398.09681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2DI0w51hY5S
Name [3-(4-tert-butylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl 4-chlorophenyl ether
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/C20H19ClN4OS/c1-20(2,3)14-6-4-13(5-7-14)18-22-23-19-25(18)24-17(27-19)12-26-16-10-8-15(21)9-11-16/h4-11H,12H2,1-3H3
InChIKey WRQZDZJSGYTELJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26019
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: D61873; Labnumber: UDSG-00122; SBI_ID: SBI-026023
Synonyms 3-(4-tert-butylphenyl)-6-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Temperature 318 °C