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1,3,5-TRINITRO-1,3,5-TRIAZACYCLOHEXANE;RDX

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1,3,5-TRINITRO-1,3,5-TRIAZACYCLOHEXANE;RDX
SpectraBase Compound ID JxCYAz5wqMK
InChI InChI=1S/C3H6N6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H2
InChIKey XTFIVUDBNACUBN-UHFFFAOYSA-N
Mol Weight 222.12 g/mol
Molecular Formula C3H6N6O6
Exact Mass 222.034882 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IkzhlPPcerr
Name CYCLOTRIMETHYLENENITRAMINE
Compound Number RDX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H6N6O6
InChI InChI=1S/C3H6N6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H2
InChIKey XTFIVUDBNACUBN-UHFFFAOYSA-N
Literature Reference Author C.M.LOCK,W.MEIER-AUGENSTEIN
Literature Reference Citation FOR.SCI.INT.,179,157(2008)
Literature Reference DOI 10.1016/j.forsciint.2008.05.015
Molecular Weight 222.117 g/mol
Sample ID 46416
Solvent ACETONE-D6