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2-(hydroxymethyl)-as-triazine-3,5(2H,4H)-dione, acetate
SpectraBase Compound ID IYI2jgUoup8
InChI InChI=1S/C6H7N3O4/c1-4(10)13-3-9-6(12)8-5(11)2-7-9/h2H,3H2,1H3,(H,8,11,12)
InChIKey RINZFXWGCLAVKU-UHFFFAOYSA-N
Mol Weight 185.14 g/mol
Molecular Formula C6H7N3O4
Exact Mass 185.043656 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1j9ukEQuzKL
Name 2-(hydroxymethyl)-as-triazine-3,5(2H,4H)-dione, acetate
Source of Sample M. Prystas, Czechoslovakian Academy of Science & Biochemistry, Prague, Czechoslovakia
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Formula C6H7N3O4
InChI InChI=1S/C6H7N3O4/c1-4(10)13-3-9-6(12)8-5(11)2-7-9/h2H,3H2,1H3,(H,8,11,12)
InChIKey RINZFXWGCLAVKU-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 3458M
Solvent TFA
Synonyms AS-TRIAZINE-3,5/2H,4H/-DIONE, 2- /HYDROXYMETHYL/-, ACETATE /ESTER/