| SpectraBase Compound ID | 7m0eaPoZEx4 |
|---|---|
| InChI | InChI=1S/C7H9N3O3/c8-5(11)3-4-10-7(13)2-1-6(12)9-10/h1-2H,3-4H2,(H2,8,11)(H,9,12) |
| InChIKey | AAYKONFWPMOCCN-UHFFFAOYSA-N |
| Mol Weight | 183.17 g/mol |
| Molecular Formula | C7H9N3O3 |
| Exact Mass | 183.064391 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8LHZiKHKxnC |
|---|---|
| Name | 2-(2-Carbamoylethyl)-2,3-dihydro-6-hydroxy-3-oxopyridazine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.064391159 u |
| Formula | C7H9N3O3 |
| InChI | InChI=1S/C7H9N3O3/c8-5(11)3-4-10-7(13)2-1-6(12)9-10/h1-2H,3-4H2,(H2,8,11)(H,9,12) |
| InChIKey | AAYKONFWPMOCCN-UHFFFAOYSA-N |
| SMILES | C=1(C=CC(N(N1)CCC(N)=O)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974554 |