| SpectraBase Compound ID | DUdF9FHiM9L |
|---|---|
| InChI | InChI=1S/C10H11N3O/c1-7-11-10(13(2)12-7)8-5-3-4-6-9(8)14/h3-6,14H,1-2H3 |
| InChIKey | FRCXMIOQFPFWKQ-UHFFFAOYSA-N |
| Mol Weight | 189.22 g/mol |
| Molecular Formula | C10H11N3O |
| Exact Mass | 189.090212 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CK2grgq8hh1 |
|---|---|
| Name | Phenol, 2-(1,3-dimethyl-1H-1,2,4-triazol-5-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.090211985 u |
| Formula | C10H11N3O |
| InChI | InChI=1S/C10H11N3O/c1-7-11-10(13(2)12-7)8-5-3-4-6-9(8)14/h3-6,14H,1-2H3 |
| InChIKey | FRCXMIOQFPFWKQ-UHFFFAOYSA-N |
| Molecular Weight | 189.218 g/mol |
| SMILES | OC1=C(C2=NC(C)=NN2C)C=CC=C1 |