![2H,5H,6H,7H,8H-[1,2,4]Triazolo[4,3-A]pyridin-3-one](/api/spectrum/7s2EfWgTJOX/structure.png?h=300&w=458 "2H,5H,6H,7H,8H-[1,2,4]Triazolo[4,3-A]pyridin-3-one")
| SpectraBase Compound ID | 2a5UzBoiVP4 |
|---|---|
| InChI | InChI=1S/C6H9N3O/c10-6-8-7-5-3-1-2-4-9(5)6/h1-4H2,(H,8,10) |
| InChIKey | VNJXPEWQUVGHKM-UHFFFAOYSA-N |
| Mol Weight | 139.16 g/mol |
| Molecular Formula | C6H9N3O |
| Exact Mass | 139.074562 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7s2EfWgTJOX |
|---|---|
| Name | 2H,5H,6H,7H,8H-[1,2,4]Triazolo[4,3-A]pyridin-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 139.074561921 u |
| Formula | C6H9N3O |
| InChI | InChI=1S/C6H9N3O/c10-6-8-7-5-3-1-2-4-9(5)6/h1-4H2,(H,8,10) |
| InChIKey | VNJXPEWQUVGHKM-UHFFFAOYSA-N |
| SMILES | C1CCN2C(C1)=NNC2=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953253 |