| SpectraBase Compound ID | DbpSHCqc0T2 |
|---|---|
| InChI | InChI=1S/C2H3N3O/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6) |
| InChIKey | LZTSCEYDCZBRCJ-UHFFFAOYSA-N |
| Mol Weight | 85.066 g/mol |
| Molecular Formula | C2H3N3O |
| Exact Mass | 85.027612 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AZz0VnimPeR |
|---|---|
| Name | 1,2,4-Triazol-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 85.027611728 u |
| Formula | C2H3N3O |
| InChI | InChI=1S/C2H3N3O/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6) |
| InChIKey | LZTSCEYDCZBRCJ-UHFFFAOYSA-N |
| Molecular Weight | 85.066 g/mol |
| SMILES | C1(NN=CN1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.966003 |