| SpectraBase Compound ID | K6pVLH2UY6s |
|---|---|
| InChI | InChI=1S/C12H13N3O4/c1-13-10(16)11(17)15-14-7-8-3-5-9(6-4-8)12(18)19-2/h3-7H,1-2H3,(H,13,16)(H,15,17)/b14-7+ |
| InChIKey | HITFZRMBSDDMAG-VGOFMYFVSA-N |
| Mol Weight | 263.25 g/mol |
| Molecular Formula | C12H13N3O4 |
| Exact Mass | 263.090606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7KpStTBPixl |
|---|---|
| Name | Terephthalaldehydic acid, methyloxamoylhydrazone, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.090605907 u |
| Formula | C12H13N3O4 |
| InChI | InChI=1S/C12H13N3O4/c1-13-10(16)11(17)15-14-7-8-3-5-9(6-4-8)12(18)19-2/h3-7H,1-2H3,(H,13,16)(H,15,17)/b14-7+ |
| InChIKey | HITFZRMBSDDMAG-VGOFMYFVSA-N |
| SMILES | C(C(=O)NC)(N\N=C\C1=CC=C(C(=O)OC)C=C1)=O |