| SpectraBase Compound ID | 2CoGzBHxpxo |
|---|---|
| InChI | InChI=1S/C13H14N4O4/c1-8-12(18)17(13(19)16-15-8)14-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H,16,19)/b14-7+ |
| InChIKey | AQXSKMYVBTVQFA-VGOFMYFVSA-N |
| Mol Weight | 290.28 g/mol |
| Molecular Formula | C13H14N4O4 |
| Exact Mass | 290.101505 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2zqs7ejfv9t |
|---|---|
| Name | 6-Methyl-4-(veratrylideneamino)-as-triazine-3,5(2H,4H)-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.101504943 u |
| Formula | C13H14N4O4 |
| InChI | InChI=1S/C13H14N4O4/c1-8-12(18)17(13(19)16-15-8)14-7-9-4-5-10(20-2)11(6-9)21-3/h4-7H,1-3H3,(H,16,19)/b14-7+ |
| InChIKey | AQXSKMYVBTVQFA-VGOFMYFVSA-N |
| SMILES | N1N=C(C(N(C1=O)\N=C\C=1C=C(C(=CC1)OC)OC)=O)C |