| SpectraBase Compound ID | 5ryNjbzXsbI |
|---|---|
| InChI | InChI=1S/C14H12N4O6/c1-8-3-4-11(9(2)5-8)15-14-12(17(21)22)6-10(16(19)20)7-13(14)18(23)24/h3-7,15H,1-2H3 |
| InChIKey | LZJGUDBNAZQZAQ-UHFFFAOYSA-N |
| Mol Weight | 332.27 g/mol |
| Molecular Formula | C14H12N4O6 |
| Exact Mass | 332.075684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 53hhU4apupW |
|---|---|
| Name | N-Picryl-2,4-xylidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.075684116 u |
| Formula | C14H12N4O6 |
| InChI | InChI=1S/C14H12N4O6/c1-8-3-4-11(9(2)5-8)15-14-12(17(21)22)6-10(16(19)20)7-13(14)18(23)24/h3-7,15H,1-2H3 |
| InChIKey | LZJGUDBNAZQZAQ-UHFFFAOYSA-N |
| Molecular Weight | 332.272 g/mol |
| SMILES | N(C=1C(=CC(=CC1)C)C)C=1C(=CC(=CC1N(=O)=O)N(=O)=O)N(=O)=O |