| SpectraBase Compound ID | GmgqBWtxKcs |
|---|---|
| InChI | InChI=1S/C9H10N4/c1-13-6-11-9(12-13)7-4-2-3-5-8(7)10/h2-6H,10H2,1H3 |
| InChIKey | UQUYETSXMOOVEP-UHFFFAOYSA-N |
| Mol Weight | 174.21 g/mol |
| Molecular Formula | C9H10N4 |
| Exact Mass | 174.090546 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4LZQdIj9y1f |
|---|---|
| Name | 2-(1-Methyl-1H-1,2,4-triazol-3-yl)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.090546338 u |
| Formula | C9H10N4 |
| InChI | InChI=1S/C9H10N4/c1-13-6-11-9(12-13)7-4-2-3-5-8(7)10/h2-6H,10H2,1H3 |
| InChIKey | UQUYETSXMOOVEP-UHFFFAOYSA-N |
| Molecular Weight | 174.207 g/mol |
| SMILES | C=1(N=CN(N1)C)C=1C(N)=CC=CC1 |