| SpectraBase Compound ID | C8cfJD2EA6z |
|---|---|
| InChI | InChI=1S/C12H9N3O3/c16-13-14(10-4-2-1-3-5-10)11-6-8-12(9-7-11)15(17)18/h1-9H |
| InChIKey | HDKIMHWOSSQGFS-UHFFFAOYSA-N |
| Mol Weight | 243.22 g/mol |
| Molecular Formula | C12H9N3O3 |
| Exact Mass | 243.064391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BPn8NtSyRTI |
|---|---|
| Name | Benzenamine, 4-nitro-N-nitroso-N-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.064391159 u |
| Formula | C12H9N3O3 |
| InChI | InChI=1S/C12H9N3O3/c16-13-14(10-4-2-1-3-5-10)11-6-8-12(9-7-11)15(17)18/h1-9H |
| InChIKey | HDKIMHWOSSQGFS-UHFFFAOYSA-N |
| Molecular Weight | 243.222 g/mol |
| SMILES | C1(N(N=O)C2=CC=CC=C2)=CC=C(N(=O)=O)C=C1 |