| SpectraBase Compound ID | 4v8dKinSYqk |
|---|---|
| InChI | InChI=1S/C6H10N2O3/c1-3-5(10)8-4(2-9)6(11)7-3/h3-4,9H,2H2,1H3,(H,7,11)(H,8,10) |
| InChIKey | JJDWARJCLFFKRT-UHFFFAOYSA-N |
| Mol Weight | 158.16 g/mol |
| Molecular Formula | C6H10N2O3 |
| Exact Mass | 158.069142 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6gnmPIm8Jxk |
|---|---|
| Name | 3-Hydroxymethyl-6-methyl-2,5-piperazinedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.069142187 u |
| Formula | C6H10N2O3 |
| InChI | InChI=1S/C6H10N2O3/c1-3-5(10)8-4(2-9)6(11)7-3/h3-4,9H,2H2,1H3,(H,7,11)(H,8,10) |
| InChIKey | JJDWARJCLFFKRT-UHFFFAOYSA-N |
| Molecular Weight | 158.157 g/mol |
| SMILES | C1(NC(C(NC1CO)=O)C)=O |