![Pyrolinamide, N-[2,4-dinitrophenyl]-](/api/spectrum/1CJ75uf4F8e/structure.png?h=300&w=458 "Pyrolinamide, N-[2,4-dinitrophenyl]-")
| SpectraBase Compound ID | 6w5eD7WIGHd |
|---|---|
| InChI | InChI=1S/C11H12N4O5/c16-11(9-2-1-5-12-9)13-8-4-3-7(14(17)18)6-10(8)15(19)20/h3-4,6,9,12H,1-2,5H2,(H,13,16) |
| InChIKey | HKDFWXXVHPGMHD-UHFFFAOYSA-N |
| Mol Weight | 280.24 g/mol |
| Molecular Formula | C11H12N4O5 |
| Exact Mass | 280.080769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1CJ75uf4F8e |
|---|---|
| Name | Pyrolinamide, N-[2,4-dinitrophenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.080769497 u |
| Formula | C11H12N4O5 |
| InChI | InChI=1S/C11H12N4O5/c16-11(9-2-1-5-12-9)13-8-4-3-7(14(17)18)6-10(8)15(19)20/h3-4,6,9,12H,1-2,5H2,(H,13,16) |
| InChIKey | HKDFWXXVHPGMHD-UHFFFAOYSA-N |
| SMILES | C1=C(C=C(C(=C1)NC(=O)C1NCCC1)N(=O)=O)N(=O)=O |