| SpectraBase Compound ID | 1Q40fnc0WMh |
|---|---|
| InChI | InChI=1S/C5H7N5O2/c6-3-2(8-1-11)4(12)10-5(7)9-3/h1H,(H,8,11)(H5,6,7,9,10,12) |
| InChIKey | RUHWEHKVKUSJAF-UHFFFAOYSA-N |
| Mol Weight | 169.14 g/mol |
| Molecular Formula | C5H7N5O2 |
| Exact Mass | 169.059974 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 82YKf3knYif |
|---|---|
| Name | Formamide, N-(2,4-diamino-1,6-dihydro-6-oxo-5-pyrimidinyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.059974483 u |
| Formula | C5H7N5O2 |
| InChI | InChI=1S/C5H7N5O2/c6-3-2(8-1-11)4(12)10-5(7)9-3/h1H,(H,8,11)(H5,6,7,9,10,12) |
| InChIKey | RUHWEHKVKUSJAF-UHFFFAOYSA-N |
| SMILES | C1(N)=NC(N)=C(NC=O)C(N1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884723 |