![N-(Oxolan-2-ylmethyl)-2-[5-(pyridin-3-yl)-1H-1,2,4-triazol-3-yl]acetamide](/api/spectrum/4tBM8QOrCDH/structure.png?h=300&w=458 "N-(Oxolan-2-ylmethyl)-2-[5-(pyridin-3-yl)-1H-1,2,4-triazol-3-yl]acetamide")
| SpectraBase Compound ID | 1fBPdavEe9O |
|---|---|
| InChI | InChI=1S/C14H17N5O2/c20-13(16-9-11-4-2-6-21-11)7-12-17-14(19-18-12)10-3-1-5-15-8-10/h1,3,5,8,11H,2,4,6-7,9H2,(H,16,20)(H,17,18,19) |
| InChIKey | SESQXJHGERSWPN-UHFFFAOYSA-N |
| Mol Weight | 287.32 g/mol |
| Molecular Formula | C14H17N5O2 |
| Exact Mass | 287.138225 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tBM8QOrCDH |
|---|---|
| Name | N-(Oxolan-2-ylmethyl)-2-[5-(pyridin-3-yl)-1H-1,2,4-triazol-3-yl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.138224805 u |
| Formula | C14H17N5O2 |
| InChI | InChI=1S/C14H17N5O2/c20-13(16-9-11-4-2-6-21-11)7-12-17-14(19-18-12)10-3-1-5-15-8-10/h1,3,5,8,11H,2,4,6-7,9H2,(H,16,20)(H,17,18,19) |
| InChIKey | SESQXJHGERSWPN-UHFFFAOYSA-N |
| Molecular Weight | 287.323 g/mol |
| SMILES | C1CC(CNC(CC=2N=C(NN2)C2=CN=CC=C2)=O)OC1 |