| SpectraBase Compound ID | 9YDClVI1moU |
|---|---|
| InChI | InChI=1S/C3H2N2O3/c6-5(7)3-1-4-8-2-3/h1-2H |
| InChIKey | LLLMLGQOFWRRTH-UHFFFAOYSA-N |
| Mol Weight | 114.06 g/mol |
| Molecular Formula | C3H2N2O3 |
| Exact Mass | 114.006542 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BmBliZgtiwS |
|---|---|
| Name | Isoxazole, 4-nitro- |
| Alternate Name(s) | 4-Nitro-1,2-oxazole 4-Nitroisoxazole |
| CAS Registry Number | 1121-13-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C3H2N2O3 |
| InChI | InChI=1S/C3H2N2O3/c6-5(7)3-1-4-8-2-3/h1-2H |
| InChIKey | LLLMLGQOFWRRTH-UHFFFAOYSA-N |
| Molecular Weight | 114.060 g/mol |
| SMILES | c1(N(=O)=O)conc1 |
| SPLASH | splash10-029b-9300000000-163bb5d485d3858fdb66 |
| Source of Spectrum | J-52-2720-0 |
| Wiley ID | 1124061 |