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1H-pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester
SpectraBase Compound ID 6xpOfljEx68
InChI InChI=1S/C9H12N6O2S/c1-6-11-12-9(15(6)10)18-5-14-4-3-7(13-14)8(16)17-2/h3-4H,5,10H2,1-2H3
InChIKey HVINESRDECREIL-UHFFFAOYSA-N
Mol Weight 268.29 g/mol
Molecular Formula C9H12N6O2S
Exact Mass 268.074245 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID He7kV66SJGG
Name 1H-pyrazole-3-carboxylic acid, 1-[[(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-, methyl ester
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/C9H12N6O2S/c1-6-11-12-9(15(6)10)18-5-14-4-3-7(13-14)8(16)17-2/h3-4H,5,10H2,1-2H3
InChIKey HVINESRDECREIL-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_6752
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: R00387; Labnumber: RIBS-10387