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6-METHYL-5-NITRO-1,1,3-TRIOXO-2H,4H-PYRAZOLO-[4,3-E]-THIADIAZINE
SpectraBase Compound ID G6zMaal4pfN
InChI InChI=1S/C5H5N5O5S/c1-9-4(10(12)13)2-3(7-9)16(14,15)8-5(11)6-2/h1H3,(H2,6,8,11)
InChIKey GMVVEEJXUQJWCJ-UHFFFAOYSA-N
Mol Weight 247.18 g/mol
Molecular Formula C5H5N5O5S
Exact Mass 247.001139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4nX04XPgOHw
Name 6-METHYL-5-NITRO-1,1,3-TRIOXO-2H,4H-PYRAZOLO-[4,3-E]-THIADIAZINE
Compound Number 6C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C5H5N5O5S/c1-9-4(10(12)13)2-3(7-9)16(14,15)8-5(11)6-2/h1H3,(H2,6,8,11)
InChIKey GMVVEEJXUQJWCJ-UHFFFAOYSA-N
Literature Reference M.E.ARRANZ,S.VEGA,J.A.DIAZ HETEROCYCLES,45,1767(1997)
Solvent Dimethyl sulfoxide-d6