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2,4-Pyrimidinedione, 1,2,3,4-tetrahydro-6-(methylamino)-5-nitro-
SpectraBase Compound ID 6ACML9CtTLu
InChI InChI=1S/C5H6N4O4/c1-6-3-2(9(12)13)4(10)8-5(11)7-3/h1H3,(H3,6,7,8,10,11)
InChIKey IJFNNWYKLVJVLY-UHFFFAOYSA-N
Mol Weight 186.13 g/mol
Molecular Formula C5H6N4O4
Exact Mass 186.038905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fNHRYLOttd
Name 2,4-Pyrimidinedione, 1,2,3,4-tetrahydro-6-(methylamino)-5-nitro-
Alternate Name(s) 6-(Methylamino)-5-nitro-2,4(1H,3H)-pyrimidinedione 6-(methylamino)-5-nitro-1H-pyrimidine-2,4-dione 2,4(1H,3H)-Pyrimidinedione, 6-(methylamino)-5-nitro- 6-(methylamino)-5-nitro-uracil
CAS Registry Number 41964-42-5
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N4O4
InChI InChI=1S/C5H6N4O4/c1-6-3-2(9(12)13)4(10)8-5(11)7-3/h1H3,(H3,6,7,8,10,11)
InChIKey IJFNNWYKLVJVLY-UHFFFAOYSA-N
Molecular Weight 186.127 g/mol
SMILES N(C1=C(C(NC(N1)=O)=O)[N+]([O-])=O)C
SPLASH splash10-066r-9300000000-39934618a1ad79f74b25
Wiley ID 1477567