| SpectraBase Compound ID | 2CoaiQsqGZM |
|---|---|
| InChI | InChI=1S/C11H13N5O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6,12H2,1H3,(H2,13,17) |
| InChIKey | QBOPUNNBTOYOBW-UHFFFAOYSA-N |
| Mol Weight | 247.26 g/mol |
| Molecular Formula | C11H13N5O2 |
| Exact Mass | 247.106925 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kc6ky0xmrWf |
|---|---|
| Name | 5-Amino-1-(4-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.106924677 u |
| Formula | C11H13N5O2 |
| InChI | InChI=1S/C11H13N5O2/c1-18-8-4-2-7(3-5-8)6-16-10(12)9(11(13)17)14-15-16/h2-5H,6,12H2,1H3,(H2,13,17) |
| InChIKey | QBOPUNNBTOYOBW-UHFFFAOYSA-N |
| Molecular Weight | 247.258 g/mol |
| SMILES | C1(=C(N(CC2=CC=C(C=C2)OC)N=N1)N)C(=O)N |