![1-[(3,4-Xylidino)methyl]-1H-benzotriazole](/api/spectrum/5UcVYIoyRg9/structure.png?h=300&w=458 "1-[(3,4-Xylidino)methyl]-1H-benzotriazole")
| SpectraBase Compound ID | 7kcgbfzZX6Y |
|---|---|
| InChI | InChI=1S/C15H16N4/c1-11-7-8-13(9-12(11)2)16-10-19-15-6-4-3-5-14(15)17-18-19/h3-9,16H,10H2,1-2H3 |
| InChIKey | VSJVZQLEOJZHTQ-UHFFFAOYSA-N |
| Mol Weight | 252.32 g/mol |
| Molecular Formula | C15H16N4 |
| Exact Mass | 252.137497 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5UcVYIoyRg9 |
|---|---|
| Name | 1-[(3,4-Xylidino)methyl]-1H-benzotriazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.137496531 u |
| Formula | C15H16N4 |
| InChI | InChI=1S/C15H16N4/c1-11-7-8-13(9-12(11)2)16-10-19-15-6-4-3-5-14(15)17-18-19/h3-9,16H,10H2,1-2H3 |
| InChIKey | VSJVZQLEOJZHTQ-UHFFFAOYSA-N |
| Molecular Weight | 252.321 g/mol |
| SMILES | N(C=1C=C(C)C(C)=CC1)CN1C=2C=CC=CC2N=N1 |