| SpectraBase Compound ID | bt7dwdXOON |
|---|---|
| InChI | InChI=1S/C5H8N2O/c1-4-3-5(8)7(2)6-4/h3H2,1-2H3 |
| InChIKey | NDELSWXIAJLWOU-UHFFFAOYSA-N |
| Mol Weight | 112.13 g/mol |
| Molecular Formula | C5H8N2O |
| Exact Mass | 112.063663 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7yOmruMwQJU |
|---|---|
| Name | 1,3-Dimethyl-2-pyrazolin-5-one |
| Alternate Name(s) | 3H-Pyrazol-3-one, 2,4-dihydro-2,5-dimethyl- 2,5-Dimethyl-2,4-dihydro-3H-pyrazol-3-one 1,3-Dimethyl-5-pyrazolinone 1,3-Dimethyl-5-pyrazolone 2,4-Dihydro-2,5-dimethyl-3H-pyrazol-3-one 2,5-Dimethyl-2-pyrazolin-3-one 2,5-Dimethyl-4H-pyrazol-3-one 2-Pyrazolin-5-one, 1,3-dimethyl- EINECS 220-389-2 |
| CAS Registry Number | 2749-59-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H8N2O |
| InChI | InChI=1S/C5H8N2O/c1-4-3-5(8)7(2)6-4/h3H2,1-2H3 |
| InChIKey | NDELSWXIAJLWOU-UHFFFAOYSA-N |
| Molecular Weight | 112.132 g/mol |
| SMILES | CN1C(=O)CC(=N1)C |
| SPLASH | splash10-01ox-9400000000-9b4ff98653e2320f8596 |
| Source of Spectrum | O-2-707-3 |
| Wiley ID | 1123034 |