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1-(4-Amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carboxylic acid
SpectraBase Compound ID 1sjRLeFqdiK
InChI InChI=1S/C8H11N7O3/c1-14(2)3-4-5(8(16)17)10-13-15(4)7-6(9)11-18-12-7/h3H2,1-2H3,(H2,9,11)(H,16,17)
InChIKey ZWFIUXTWQRVAQO-UHFFFAOYSA-N
Mol Weight 253.22 g/mol
Molecular Formula C8H11N7O3
Exact Mass 253.092337 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IEr6gtSdWlm
Name 1H-1,2,3-triazole-4-carboxylic acid, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.092337239 u
Formula C8H11N7O3
InChI InChI=1S/C8H11N7O3/c1-14(2)3-4-5(8(16)17)10-13-15(4)7-6(9)11-18-12-7/h3H2,1-2H3,(H2,9,11)(H,16,17)
InChIKey ZWFIUXTWQRVAQO-UHFFFAOYSA-N
Molecular Weight 253.222 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14379
Solvent DMSO-d6
Source Vendor ID: NMR/10320561; Lab Info: VUR; Lab Number: VUR-01012534