| SpectraBase Compound ID | 6MzovLbCBge |
|---|---|
| InChI | InChI=1S/C14H9N3O6/c18-15(19)12-8-7-11(14(9-12)17(22)23)6-5-10-3-1-2-4-13(10)16(20)21/h1-9H |
| InChIKey | ZFNHLPUHTFNCSA-UHFFFAOYSA-N |
| Mol Weight | 315.24 g/mol |
| Molecular Formula | C14H9N3O6 |
| Exact Mass | 315.049135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7u5eQVawDzX |
|---|---|
| Name | 2,2',4-Trinitrostilbene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.049135016 u |
| Formula | C14H9N3O6 |
| InChI | InChI=1S/C14H9N3O6/c18-15(19)12-8-7-11(14(9-12)17(22)23)6-5-10-3-1-2-4-13(10)16(20)21/h1-9H |
| InChIKey | ZFNHLPUHTFNCSA-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C1=CC=C(C(=C1)N(=O)=O)C=CC1=CC=CC=C1N(=O)=O |