| SpectraBase Compound ID | 2a3qCRkkQ9I |
|---|---|
| InChI | InChI=1S/C6H3N3O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H |
| InChIKey | UATJOMSPNYCXIX-UHFFFAOYSA-N |
| Mol Weight | 213.1 g/mol |
| Molecular Formula | C6H3N3O6 |
| Exact Mass | 213.002185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2LU6wB1DqWc |
|---|---|
| Name | 1,3,5-TRINITROBENZENE;92-049 |
| Compound Number | 129 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H3N3O6 |
| InChI | InChI=1S/C6H3N3O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H |
| InChIKey | UATJOMSPNYCXIX-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 213.106 g/mol |
| Sample ID | 3515 |
| Solvent | DMSO-D6 |