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2-(6-bromanyl-5-methyl-7-oxidanylidene-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)ethanoic acid
SpectraBase Compound ID 3wSIbU4Cl5v
InChI InChI=1S/C8H7BrN4O3/c1-3-6(9)7(16)13-8(10-3)11-4(12-13)2-5(14)15/h2H2,1H3,(H,14,15)(H,10,11,12)
InChIKey ILTPHTYCLWEVCL-UHFFFAOYSA-N
Mol Weight 287.07 g/mol
Molecular Formula C8H7BrN4O3
Exact Mass 285.970153 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5GlhwYO3z6g
Name [1,2,4]triazolo[1,5-a]pyrimidine-2-acetic acid, 6-bromo-4,7-dihydro-5-methyl-7-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.970153098 u
Formula C8H7BrN4O3
InChI InChI=1S/C8H7BrN4O3/c1-3-6(9)7(16)13-8(10-3)11-4(12-13)2-5(14)15/h2H2,1H3,(H,14,15)(H,10,11,12)
InChIKey ILTPHTYCLWEVCL-UHFFFAOYSA-N
Molecular Weight 287.073 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17755
Solvent DMSO-d6
Source Vendor ID: JOC97/12169; Lab Info:##$NAME= [1,2,4]triazolo[1,5-a]pyrimidine-2-acetic acid, 6-bromo-4,7-dihydro-5-methyl-7-oxo-