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3-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
SpectraBase Compound ID Ivv9ERSoL24
InChI InChI=1S/C17H11BrN4O2S/c18-12-4-1-10(2-5-12)13-8-25-17-20-19-16(22(17)21-13)11-3-6-14-15(7-11)24-9-23-14/h1-7H,8-9H2
InChIKey OXXYHQXRGLPALZ-UHFFFAOYSA-N
Mol Weight 415.27 g/mol
Molecular Formula C17H11BrN4O2S
Exact Mass 413.97861 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3mbKKV835cn
Name 3-(1,3-benzodioxol-5-yl)-6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.978609782 u
Formula C17H11BrN4O2S
InChI InChI=1S/C17H11BrN4O2S/c18-12-4-1-10(2-5-12)13-8-25-17-20-19-16(22(17)21-13)11-3-6-14-15(7-11)24-9-23-14/h1-7H,8-9H2
InChIKey OXXYHQXRGLPALZ-UHFFFAOYSA-N
Molecular Weight 415.265 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8480
Solvent DMSO-d6
Source Vendor ID: NMR/13219692