| SpectraBase Compound ID | 42Rm01BZCAN |
|---|---|
| InChI | InChI=1S/C6H10N2O/c1-4-6(2,3)5(9)8-7-4/h1-3H3,(H,8,9)/i2D3 |
| InChIKey | OYYADIVZIRDZGB-BMSJAHLVSA-N |
| Mol Weight | 129.18 g/mol |
| Molecular Formula | C6H7D3N2O |
| Exact Mass | 129.098143 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dy2lGJiOSRL |
|---|---|
| Name | 4-Trideuteriomethyl-3,4-dimethyl-2-pyrazolin-5-one |
| CAS Registry Number | 55570-87-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7D3N2O |
| InChI | InChI=1S/C6H10N2O/c1-4-6(2,3)5(9)8-7-4/h1-3H3,(H,8,9)/i2D3 |
| InChIKey | OYYADIVZIRDZGB-BMSJAHLVSA-N |
| Molecular Weight | 129.177 g/mol |
| SMILES | N1N=C(C(C1=O)(C)C([D])([D])[D])C |
| SPLASH | splash10-0006-9300000000-fcfc39275feaf1c23070 |
| Source of Spectrum | AN-82-764-20 |
| Wiley ID | 1129781 |