| 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
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| SpectraBase Spectrum ID | 1XIhqXSMmGL |
|---|---|
| Name | 1,3,5-TRINITRO-1,3,5-TRIAZACYCLOHEXANE;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 | M.SZALA,L.SZYMANCZYK |
| Literature Reference Citation | C.EUR.J.EN.MAT.,11,129(2014) |
| Molecular Weight | 222.117 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU80414 |