| SpectraBase Compound ID | 1so2VadcqcM |
|---|---|
| InChI | InChI=1S/C16H11N3O2/c17-10-13-8-4-5-9-14(13)18-19-15(11-20)16(21)12-6-2-1-3-7-12/h1-9,11,18H/b19-15+ |
| InChIKey | AFPKCIZWFFZEAV-XDJHFCHBSA-N |
| Mol Weight | 277.28 g/mol |
| Molecular Formula | C16H11N3O2 |
| Exact Mass | 277.085127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bydl696MzTU |
|---|---|
| Name | Propanetrione, 1-phenyl-, 2-(2-cyanophenyl)hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.085126604 u |
| Formula | C16H11N3O2 |
| InChI | InChI=1S/C16H11N3O2/c17-10-13-8-4-5-9-14(13)18-19-15(11-20)16(21)12-6-2-1-3-7-12/h1-9,11,18H/b19-15+ |
| InChIKey | AFPKCIZWFFZEAV-XDJHFCHBSA-N |
| Molecular Weight | 277.283 g/mol |
| SMILES | C1=CC(C(=O)\C(C=O)=N\NC=2C=CC=CC2C#N)=CC=C1 |