| SpectraBase Compound ID | KXGiL88JPmE |
|---|---|
| InChI | InChI=1S/C14H13NO2/c1-10-8-13(12-6-4-3-5-7-12)9-11(2)14(10)15(16)17/h3-9H,1-2H3 |
| InChIKey | AWZXPCPKJAORSZ-UHFFFAOYSA-N |
| Mol Weight | 227.26 g/mol |
| Molecular Formula | C14H13NO2 |
| Exact Mass | 227.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JjRxOVzMtmC |
|---|---|
| Name | 1,1'-Biphenyl, 3,5-dimethyl-4-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.094628661 u |
| Formula | C14H13NO2 |
| InChI | InChI=1S/C14H13NO2/c1-10-8-13(12-6-4-3-5-7-12)9-11(2)14(10)15(16)17/h3-9H,1-2H3 |
| InChIKey | AWZXPCPKJAORSZ-UHFFFAOYSA-N |
| Molecular Weight | 227.263 g/mol |
| SMILES | C1(N(=O)=O)=C(C=C(C=C1C)C1=CC=CC=C1)C |