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1-(4-Amino-furazan-3-yl)-5-pyridin-4-yl-1H-[1,2,3]triazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID 6KwoeIVTrao
InChI InChI=1S/C12H11N7O3/c1-2-21-12(20)8-9(7-3-5-14-6-4-7)19(18-15-8)11-10(13)16-22-17-11/h3-6H,2H2,1H3,(H2,13,16)
InChIKey DIFSQYBBNDTZBC-UHFFFAOYSA-N
Mol Weight 301.27 g/mol
Molecular Formula C12H11N7O3
Exact Mass 301.092337 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4lSMGglGIK9
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-pyridinyl)-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 301.092337239 u
Formula C12H11N7O3
InChI InChI=1S/C12H11N7O3/c1-2-21-12(20)8-9(7-3-5-14-6-4-7)19(18-15-8)11-10(13)16-22-17-11/h3-6H,2H2,1H3,(H2,13,16)
InChIKey DIFSQYBBNDTZBC-UHFFFAOYSA-N
Molecular Weight 301.266 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12312
Solvent DMSO-d6
Source Vendor ID: NMR/10272104; Lab Info: VUR; Lab Number: VUR-0001678