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6-(2-bromophenyl)-3-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID 3XDn3ghOalt
InChI InChI=1S/C16H10BrClN4S/c17-13-4-2-1-3-12(13)14-9-23-16-20-19-15(22(16)21-14)10-5-7-11(18)8-6-10/h1-8H,9H2
InChIKey KRBOZHAEXVDYTB-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 45b8r4y6SKL
Name 6-(2-bromophenyl)-3-(4-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/c17-13-4-2-1-3-12(13)14-9-23-16-20-19-15(22(16)21-14)10-5-7-11(18)8-6-10/h1-8H,9H2
InChIKey KRBOZHAEXVDYTB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26083
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: D61953; Labnumber: UDSG-00778; SBI_ID: SBI-026087
Temperature 315 °C