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3-(4-tert-butylphenyl)-6-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

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3-(4-tert-butylphenyl)-6-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID G69PvzPLCxj
InChI InChI=1S/C19H16Cl2N4S/c1-19(2,3)12-6-4-11(5-7-12)16-22-23-18-25(16)24-17(26-18)14-9-8-13(20)10-15(14)21/h4-10H,1-3H3
InChIKey LIEMRAZYKCOIBP-UHFFFAOYSA-N
Mol Weight 403.33 g/mol
Molecular Formula C19H16Cl2N4S
Exact Mass 402.047273 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1tgc0bDouKL
Name 3-(4-tert-butylphenyl)-6-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
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/C19H16Cl2N4S/c1-19(2,3)12-6-4-11(5-7-12)16-22-23-18-25(16)24-17(26-18)14-9-8-13(20)10-15(14)21/h4-10H,1-3H3
InChIKey LIEMRAZYKCOIBP-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19375
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: D13377; Labnumber: GRES-04925; SBI_ID: SBI-019378
Temperature 308 °C