| SpectraBase Compound ID | 9QuM68MIT1a |
|---|---|
| InChI | InChI=1S/C11H11N5O2/c1-18-9-4-2-8(3-5-9)6-12-15-11-14-10(17)7-13-16-11/h2-7H,1H3,(H2,14,15,16,17)/b12-6+ |
| InChIKey | XPUNSDGHRHAXIR-WUXMJOGZSA-N |
| Mol Weight | 245.24 g/mol |
| Molecular Formula | C11H11N5O2 |
| Exact Mass | 245.091275 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FsvXiOmvSuP |
|---|---|
| Name | Benzaldehyde, 4-methoxy-, (4,5-dihydro-5-oxo-1,2,4-triazin-3-yl)hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.091274612 u |
| Formula | C11H11N5O2 |
| InChI | InChI=1S/C11H11N5O2/c1-18-9-4-2-8(3-5-9)6-12-15-11-14-10(17)7-13-16-11/h2-7H,1H3,(H2,14,15,16,17)/b12-6+ |
| InChIKey | XPUNSDGHRHAXIR-WUXMJOGZSA-N |
| Molecular Weight | 245.242 g/mol |
| SMILES | N(\N=C\C1=CC=C(C=C1)OC)C=1NC(C=NN1)=O |