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s-TRIAZOLO[5,1-c]-as-TRIAZIN-4(1H)-ONE

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s-TRIAZOLO[5,1-c]-as-TRIAZIN-4(1H)-ONE
SpectraBase Compound ID IWpmcDqKPcU
InChI InChI=1S/C4H3N5O/c10-3-1-6-8-4-5-2-7-9(3)4/h1-2H,(H,5,7,8)
InChIKey LOBCIVCNIBYPOH-UHFFFAOYSA-N
Mol Weight 137.1 g/mol
Molecular Formula C4H3N5O
Exact Mass 137.03376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7D40uShsta4
Name 4,7-Dihydro-7-oxo-1,2,4-triazolo(5,1-C)-1,2,4-triazine
CAS Registry Number 57351-74-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C4H3N5O
InChI InChI=1S/C4H3N5O/c10-3-1-6-8-4-5-2-7-9(3)4/h1-2H,(H,5,7,8)
InChIKey LOBCIVCNIBYPOH-UHFFFAOYSA-N
Instrument Name PE R-26
Literature Reference M.M. Goodman, W.W. Paudler, J. Org. Chem. 42, 1866 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6