| SpectraBase Compound ID | 7sb03MZhBIn |
|---|---|
| InChI | InChI=1S/C6H2ClN3O6/c7-6-4(9(13)14)1-3(8(11)12)2-5(6)10(15)16/h1-2H |
| InChIKey | HJRJRUMKQCMYDL-UHFFFAOYSA-N |
| Mol Weight | 247.55 g/mol |
| Molecular Formula | C6H2ClN3O6 |
| Exact Mass | 246.963212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8DC1rIOlgh3 |
|---|---|
| Name | 1-CHLORO-2,4,6-TRINITROBENZENE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H2ClN3O6 |
| InChI | InChI=1S/C6H2ClN3O6/c7-6-4(9(13)14)1-3(8(11)12)2-5(6)10(15)16/h1-2H |
| InChIKey | HJRJRUMKQCMYDL-UHFFFAOYSA-N |
| Literature Reference Author | J.MUELLER |
| Literature Reference Citation | Z.NATURFORSCH.,34B,437(1979) |
| Molecular Weight | 247.551 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWCS12211 |