| SpectraBase Compound ID | 2XClGM88Tlw |
|---|---|
| InChI | InChI=1S/C13H12N4/c1-2-6-11(7-3-1)14-10-17-13-9-5-4-8-12(13)15-16-17/h1-9,14H,10H2 |
| InChIKey | XEZLZOGOVRJQMO-UHFFFAOYSA-N |
| Mol Weight | 224.27 g/mol |
| Molecular Formula | C13H12N4 |
| Exact Mass | 224.106196 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E2pxxJTzWfL |
|---|---|
| Name | 1-(Anilinomethyl)-1H-benzotriazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.106196402 u |
| Formula | C13H12N4 |
| InChI | InChI=1S/C13H12N4/c1-2-6-11(7-3-1)14-10-17-13-9-5-4-8-12(13)15-16-17/h1-9,14H,10H2 |
| InChIKey | XEZLZOGOVRJQMO-UHFFFAOYSA-N |
| SMILES | N(CN1N=NC=2C=CC=CC12)C=1C=CC=CC1 |