| SpectraBase Compound ID | FBQOljbXgNx |
|---|---|
| InChI | InChI=1S/C14H12N4O4/c1-2-10-3-5-11(6-4-10)15-16-13-8-7-12(17(19)20)9-14(13)18(21)22/h3-9H,2H2,1H3/b16-15+ |
| InChIKey | FQAHKKJEMQCXTN-FOCLMDBBSA-N |
| Mol Weight | 300.27 g/mol |
| Molecular Formula | C14H12N4O4 |
| Exact Mass | 300.085855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F4a3U1FNQ0a |
|---|---|
| Name | 4'-Ethyl-2,4-dinitroazobenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.085854878 u |
| Formula | C14H12N4O4 |
| InChI | InChI=1S/C14H12N4O4/c1-2-10-3-5-11(6-4-10)15-16-13-8-7-12(17(19)20)9-14(13)18(21)22/h3-9H,2H2,1H3/b16-15+ |
| InChIKey | FQAHKKJEMQCXTN-FOCLMDBBSA-N |
| SMILES | C1(N(=O)=O)=CC(N(=O)=O)=CC=C1\N=N\C=1C=CC(=CC1)CC |