| SpectraBase Compound ID | KbywVLe8cbm |
|---|---|
| InChI | InChI=1S/C13H16N2O3/c1-4-18-13(17)12(10(3)16)15-14-11-8-6-5-7-9(11)2/h5-8,14H,4H2,1-3H3/b15-12+ |
| InChIKey | PTVRFGJEUPUIAS-NTCAYCPXSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C13H16N2O3 |
| Exact Mass | 248.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B5X4anJBflM |
|---|---|
| Name | 2,3-Dioxobutyric acid, ethyl ester, 2-o-tolylhydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.116092380 u |
| Formula | C13H16N2O3 |
| InChI | InChI=1S/C13H16N2O3/c1-4-18-13(17)12(10(3)16)15-14-11-8-6-5-7-9(11)2/h5-8,14H,4H2,1-3H3/b15-12+ |
| InChIKey | PTVRFGJEUPUIAS-NTCAYCPXSA-N |
| Molecular Weight | 248.282 g/mol |
| SMILES | N(C1=CC=CC=C1C)\N=C\(C(OCC)=O)C(C)=O |