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6-(4-bromophenyl)-3-(2-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID HXyei8zNL1f
InChI InChI=1S/C16H10BrClN4S/c17-11-7-5-10(6-8-11)14-9-23-16-20-19-15(22(16)21-14)12-3-1-2-4-13(12)18/h1-8H,9H2
InChIKey SMTOEWJEUWPEQE-UHFFFAOYSA-N
Mol Weight 405.7 g/mol
Molecular Formula C16H10BrClN4S
Exact Mass 403.949808 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FfoDd0Oamtd
Name 6-(4-bromophenyl)-3-(2-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
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/C16H10BrClN4S/c17-11-7-5-10(6-8-11)14-9-23-16-20-19-15(22(16)21-14)12-3-1-2-4-13(12)18/h1-8H,9H2
InChIKey SMTOEWJEUWPEQE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19730
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: D14371; Labnumber: UDSG-01011; SBI_ID: SBI-019734
Temperature 318 °C