| SpectraBase Compound ID | 2AXoEO45iux |
|---|---|
| InChI | InChI=1S/C11H12N4O2/c1-16-9-3-4-10(17-2)8(5-9)6-12-11-13-7-14-15-11/h3-7H,1-2H3,(H,13,14,15)/b12-6+ |
| InChIKey | ICAGPLQUUSSOOZ-WUXMJOGZSA-N |
| Mol Weight | 232.24 g/mol |
| Molecular Formula | C11H12N4O2 |
| Exact Mass | 232.096026 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L5kSZGTX743 |
|---|---|
| Name | 1,2,4-Triazole, 3-(3,6-dimethoxybenzylidenamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.096025640 u |
| Formula | C11H12N4O2 |
| InChI | InChI=1S/C11H12N4O2/c1-16-9-3-4-10(17-2)8(5-9)6-12-11-13-7-14-15-11/h3-7H,1-2H3,(H,13,14,15)/b12-6+ |
| InChIKey | ICAGPLQUUSSOOZ-WUXMJOGZSA-N |
| Molecular Weight | 232.243 g/mol |
| SMILES | C1(=C(C=C(C=C1)OC)\C=N\C=1N=CNN1)OC |