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1,3-Dinitro-4,6-bis(trifluoroacetyl)hexahydroimidazo[4,5-d]imidazol-2(1H)-one
SpectraBase Compound ID B8FVV3uR2YN
InChI InChI=1S/C8H4F6N6O7/c9-7(10,11)4(21)15-1-16(5(22)8(12,13)14)3-2(15)17(19(24)25)6(23)18(3)20(26)27/h2-3H,1H2
InChIKey OWBBWPSFSCBBDV-UHFFFAOYSA-N
Mol Weight 410.15 g/mol
Molecular Formula C8H4F6N6O7
Exact Mass 410.004565 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ixIrQjNeP9
Name 1,3-DINITRO-4,6-BIS-(TRIFLUOROACETYL)-HEXAHYDROIMIDAZO-[4,5-D]-IMIDAZOL-2-(1H)-ONE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H4F6N6O7
InChI InChI=1S/C8H4F6N6O7/c9-7(10,11)4(21)15-1-16(5(22)8(12,13)14)3-2(15)17(19(24)25)6(23)18(3)20(26)27/h2-3H,1H2
InChIKey OWBBWPSFSCBBDV-UHFFFAOYSA-N
Literature Reference Author I.J.DAGLEY,J.L.FLIPPEN-ANDERSON
Literature Reference Citation AUSTR.J.CHEM.,47,2033(1994)
Literature Reference DOI 10.1071/ch9942033
Molecular Weight 410.146 g/mol
Solvent ACETONE-D6
Source File Reference UWVP6566