| SpectraBase Compound ID | 8rXzMjRmfDz |
|---|---|
| InChI | InChI=1S/C16H14N2O2/c1-13-5-2-3-7-16(13)17-12-4-6-14-8-10-15(11-9-14)18(19)20/h2-12H,1H3/b6-4+,17-12+ |
| InChIKey | VNVKHBXBYCACOA-XZXLCCGISA-N |
| Mol Weight | 266.3 g/mol |
| Molecular Formula | C16H14N2O2 |
| Exact Mass | 266.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KlNLXTiPZeT |
|---|---|
| Name | N-(4-Nitrocinnamylidene)-o-toluidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.105527697 u |
| Formula | C16H14N2O2 |
| InChI | InChI=1S/C16H14N2O2/c1-13-5-2-3-7-16(13)17-12-4-6-14-8-10-15(11-9-14)18(19)20/h2-12H,1H3/b6-4+,17-12+ |
| InChIKey | VNVKHBXBYCACOA-XZXLCCGISA-N |
| Molecular Weight | 266.300 g/mol |
| SMILES | C1(\N=C\C=C\C2=CC=C(C=C2)N(=O)=O)=CC=CC=C1C |