| SpectraBase Compound ID | 4BTc0faOdhO |
|---|---|
| InChI | InChI=1S/C15H12N2O4/c1-10-2-4-12(17(18)19)7-13(10)16-8-11-3-5-14-15(6-11)21-9-20-14/h2-8H,9H2,1H3/b16-8+ |
| InChIKey | CIYCQECSZIJWME-LZYBPNLTSA-N |
| Mol Weight | 284.27 g/mol |
| Molecular Formula | C15H12N2O4 |
| Exact Mass | 284.079707 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JzRIKJ6U5uq |
|---|---|
| Name | 5-Nitro-N-piperonylidene-o-toluidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.079706870 u |
| Formula | C15H12N2O4 |
| InChI | InChI=1S/C15H12N2O4/c1-10-2-4-12(17(18)19)7-13(10)16-8-11-3-5-14-15(6-11)21-9-20-14/h2-8H,9H2,1H3/b16-8+ |
| InChIKey | CIYCQECSZIJWME-LZYBPNLTSA-N |
| Molecular Weight | 284.271 g/mol |
| SMILES | N(=O)(=O)C=1C=C(C(=CC1)C)\N=C\C=1C=C2C(=CC1)OCO2 |