SpectraBase Compound ID | FREmMnDnpqL |
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InChI | InChI=1S/C4H6N2O3/c7-1-2-3(8)6-4(9)5-2/h2,7H,1H2,(H2,5,6,8,9) |
InChIKey | CBRIRBXLTFAPOM-UHFFFAOYSA-N |
Mol Weight | 130.1 g/mol |
Molecular Formula | C4H6N2O3 |
Exact Mass | 130.037842 g/mol |
SpectraBase Spectrum ID | 4S6A7rjairf |
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Name | 5-(Hydroxymethyl)-2,4-imidazolidinedione |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 130.037842058 u |
Formula | C4H6N2O3 |
InChI | InChI=1S/C4H6N2O3/c7-1-2-3(8)6-4(9)5-2/h2,7H,1H2,(H2,5,6,8,9) |
InChIKey | CBRIRBXLTFAPOM-UHFFFAOYSA-N |
SMILES | C1(NC(C(N1)CO)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.815863 |