| SpectraBase Compound ID | FhXW6W655fY |
|---|---|
| InChI | InChI=1S/C9H15NO4/c1-3-8(11)7(2)9(12)5-4-6-10(13)14/h7H,3-6H2,1-2H3 |
| InChIKey | IKIOZLQJBVXHRW-UHFFFAOYSA-N |
| Mol Weight | 201.22 g/mol |
| Molecular Formula | C9H15NO4 |
| Exact Mass | 201.100108 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7NYdl6u7I53 |
|---|---|
| Name | 4-Methyl-8-nitro-3,5-octanedione |
| CAS Registry Number | 79630-95-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15NO4 |
| InChI | InChI=1S/C9H15NO4/c1-3-8(11)7(2)9(12)5-4-6-10(13)14/h7H,3-6H2,1-2H3 |
| InChIKey | IKIOZLQJBVXHRW-UHFFFAOYSA-N |
| Molecular Weight | 201.222 g/mol |
| SMILES | C(=O)(CC)C(C)C(=O)CCCN(=O)=O |
| SPLASH | splash10-0a4i-9200000000-7dbc7003613e228d1c21 |
| Synonyms | 4-Methyl-8-nitro-octane-3,5-dione |
| Wiley ID | 1480617 |