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1H-1,2,3-triazole-4-carboxylic acid, 5-[[4-(aminocarbonyl)-1-piperidinyl]methyl]-1-(4-amino-1,2,5-oxadiazol-3-yl)-, methyl ester

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1H-1,2,3-triazole-4-carboxylic acid, 5-[[4-(aminocarbonyl)-1-piperidinyl]methyl]-1-(4-amino-1,2,5-oxadiazol-3-yl)-, methyl ester
SpectraBase Compound ID HO4KX6gSMKb
InChI InChI=1S/C13H18N8O4/c1-24-13(23)9-8(6-20-4-2-7(3-5-20)11(15)22)21(19-16-9)12-10(14)17-25-18-12/h7H,2-6H2,1H3,(H2,14,17)(H2,15,22)
InChIKey FEAFLUSCELXFFL-UHFFFAOYSA-N
Mol Weight 350.34 g/mol
Molecular Formula C13H18N8O4
Exact Mass 350.145101 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CIGwo3Pz0PY
Name 1H-1,2,3-triazole-4-carboxylic acid, 5-[[4-(aminocarbonyl)-1-piperidinyl]methyl]-1-(4-amino-1,2,5-oxadiazol-3-yl)-, 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/C13H18N8O4/c1-24-13(23)9-8(6-20-4-2-7(3-5-20)11(15)22)21(19-16-9)12-10(14)17-25-18-12/h7H,2-6H2,1H3,(H2,14,17)(H2,15,22)
InChIKey FEAFLUSCELXFFL-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1558
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: NMR/9211464; Labnumber: L-19,Rozhkov
Temperature 297 °C