| SpectraBase Compound ID | CJWJLwftPxr |
|---|---|
| InChI | InChI=1S/C9H5N5O2/c10-5-7-6-11-13(12-7)8-1-3-9(4-2-8)14(15)16/h1-4,6H |
| InChIKey | FEUONYVJAZFTQV-UHFFFAOYSA-N |
| Mol Weight | 215.17 g/mol |
| Molecular Formula | C9H5N5O2 |
| Exact Mass | 215.044324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GeOp2sAxjoU |
|---|---|
| Name | 2H-1,2,3-Triazole-4-carbonitrile, 2-(4-nitrophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.044324419 u |
| Formula | C9H5N5O2 |
| InChI | InChI=1S/C9H5N5O2/c10-5-7-6-11-13(12-7)8-1-3-9(4-2-8)14(15)16/h1-4,6H |
| InChIKey | FEUONYVJAZFTQV-UHFFFAOYSA-N |
| SMILES | C1(=NN(N=C1)C1=CC=C(N(=O)=O)C=C1)C#N |