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6-(4-Bromo-phenyl)-3-butyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID DEUjkqezG2r
InChI InChI=1S/C14H15BrN4S/c1-2-3-4-13-16-17-14-19(13)18-12(9-20-14)10-5-7-11(15)8-6-10/h5-8H,2-4,9H2,1H3
InChIKey ISOISMCIIXPRBJ-UHFFFAOYSA-N
Mol Weight 351.27 g/mol
Molecular Formula C14H15BrN4S
Exact Mass 350.020081 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4qokzDhjAdV
Name 7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 6-(4-bromophenyl)-3-butyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.020080673 u
Formula C14H15BrN4S
InChI InChI=1S/C14H15BrN4S/c1-2-3-4-13-16-17-14-19(13)18-12(9-20-14)10-5-7-11(15)8-6-10/h5-8H,2-4,9H2,1H3
InChIKey ISOISMCIIXPRBJ-UHFFFAOYSA-N
Molecular Weight 351.266 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16227
Solvent DMSO-d6
Source Vendor ID: NMR/10321196; Lab Info: DEM; Lab Number: DEM-0000344