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1,2,5-oxadiazole-3-carbonitrile, 4-[[[(4-cyano-1,2,5-oxadiazol-3-yl)amino]methyl]amino]-
SpectraBase Compound ID BL2JACdNHv0
InChI InChI=1S/C7H4N8O2/c8-1-4-6(14-16-12-4)10-3-11-7-5(2-9)13-17-15-7/h3H2,(H,10,14)(H,11,15)
InChIKey RISXIJLAIWVJML-UHFFFAOYSA-N
Mol Weight 232.16 g/mol
Molecular Formula C7H4N8O2
Exact Mass 232.045721 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LiKmEfpJNV2
Name 1,2,5-oxadiazole-3-carbonitrile, 4-[[[(4-cyano-1,2,5-oxadiazol-3-yl)amino]methyl]amino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.045721399 u
Formula C7H4N8O2
InChI InChI=1S/C7H4N8O2/c8-1-4-6(14-16-12-4)10-3-11-7-5(2-9)13-17-15-7/h3H2,(H,10,14)(H,11,15)
InChIKey RISXIJLAIWVJML-UHFFFAOYSA-N
Molecular Weight 232.163 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8129
Solvent DMSO-d6
Source Vendor ID: NMR/9312776; Lab Info: LP; Lab Number: LP-4013009