| SpectraBase Compound ID | A2yDykrT1LT |
|---|---|
| InChI | InChI=1S/C6H3N3O8/c10-5-2(7(12)13)1-3(8(14)15)6(11)4(5)9(16)17/h1,10-11H |
| InChIKey | IXHMHWIBCIYOAZ-UHFFFAOYSA-N |
| Mol Weight | 245.1 g/mol |
| Molecular Formula | C6H3N3O8 |
| Exact Mass | 244.992014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXEGkY7fQL1 |
|---|---|
| Name | STYPHNIC-ACID;2,4,6-TRINITRORESORCINE;92-056 |
| Compound Number | 129 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H3N3O8 |
| InChI | InChI=1S/C6H3N3O8/c10-5-2(7(12)13)1-3(8(14)15)6(11)4(5)9(16)17/h1,10-11H |
| InChIKey | IXHMHWIBCIYOAZ-UHFFFAOYSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 245.105 g/mol |
| Sample ID | 3519 |
| Solvent | DMSO-D6 |