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1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-methylethyl)-, methyl ester
SpectraBase Compound ID 9ylCkNIMrDW
InChI InChI=1S/C9H12N6O3/c1-4(2)6-5(9(16)17-3)11-14-15(6)8-7(10)12-18-13-8/h4H,1-3H3,(H2,10,12)
InChIKey LOXASWJRZJBZKW-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C9H12N6O3
Exact Mass 252.097088 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FnLVN8cxOVy
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-methylethyl)-, 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/C9H12N6O3/c1-4(2)6-5(9(16)17-3)11-14-15(6)8-7(10)12-18-13-8/h4H,1-3H3,(H2,10,12)
InChIKey LOXASWJRZJBZKW-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_2540
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/9291164; Labnumber: VUR-0000577
Temperature 297 °C